1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one

C197H356N28O14 — CID 159464147

IUPAC1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one
SMILESCNC1CCCC(C)N(C2CC3CCC(C3)C2)C1=O.CNC1CCCC(C)N(C2CC=CC2)C1=O.CNC1CCCC(C)N(C2CC=CCC2)C1=O.CNC1CCCC(C)N(C2CCC2)C1=O.CNC1CCCC(C)N(C2CCC3CC3C2)C1=O.CNC1CCCC(C)N(C2CCCC2)C1=O.CNC1CCCC(C)N(C2CCCCC2)C1=O.CNC1CCCC(C)N(C2CCCCCC2)C1=O.CNC1CCCC(C)N(CC2CC2)C1=O.CNC1CCCC(C)N(CC2CCC2)C1=O.CNC1CCCC(C)N(CC2CCC3CC32)C1=O.CNC1CCCC(C)N(CC2CCCC2)C1=O.CNC1CCCC(C)N(CC2CCCCC2)C1=O.CNC1CCCC(C)N(CC2CCCCCC2)C1=O
InChIInChI=1S/C16H28N2O.C16H30N2O.2C15H26N2O.2C15H28N2O.2C14H26N2O.C14H24N2O.2C13H24N2O.C13H22N2O.2C12H22N2O/c1-11-4-3-5-15(17-2)16(19)18(11)14-9-12-6-7-13(8-12)10-14;1-13-8-7-11-15(17-2)16(19)18(13)12-14-9-5-3-4-6-10-14;1-10-4-3-5-14(16-2)15(18)17(10)13-7-6-11-8-12(11)9-13;1-10-4-3-5-14(16-2)15(18)17(10)9-12-7-6-11-8-13(11)12;1-12-7-6-10-14(16-2)15(18)17(12)11-13-8-4-3-5-9-13;1-12-8-7-11-14(16-2)15(18)17(12)13-9-5-3-4-6-10-13;1-11-6-5-9-13(15-2)14(17)16(11)10-12-7-3-4-8-12;2*1-11-7-6-10-13(15-2)14(17)16(11)12-8-4-3-5-9-12;1-10-5-3-8-12(14-2)13(16)15(10)9-11-6-4-7-11;2*1-10-6-5-9-12(14-2)13(16)15(10)11-7-3-4-8-11;1-9-5-3-8-11(13-2)12(15)14(9)10-6-4-7-10;1-9-4-3-5-11(13-2)12(15)14(9)8-10-6-7-10/h11-15,17H,3-10H2,1-2H3;13-15,17H,3-12H2,1-2H3;2*10-14,16H,3-9H2,1-2H3;2*12-14,16H,3-11H2,1-2H3;2*11-13,15H,3-10H2,1-2H3;3-4,11-13,15H,5-10H2,1-2H3;2*10-12,14H,3-9H2,1-2H3;3-4,10-12,14H,5-9H2,1-2H3;2*9-11,13H,3-8H2,1-2H3
InChIKeyLUYUFHKXOQUMOP-UHFFFAOYSA-N
MW3341.20 g/mol
LogP29.80
Rot. Bonds34

About 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one

1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one (PubChem CID 159464147) has the molecular formula C197H356N28O14 and a molecular weight of 3341.20 g/mol. Its IUPAC name is 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one.

Molecular Properties

Compound Name1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one
PubChem CID159464147
Molecular FormulaC197H356N28O14
Molecular Weight3341.20 g/mol
Exact Mass3338.80
IUPAC Name1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one
SMILESCNC1CCCC(C)N(C2CC3CCC(C3)C2)C1=O.CNC1CCCC(C)N(C2CC=CC2)C1=O.CNC1CCCC(C)N(C2CC=CCC2)C1=O.CNC1CCCC(C)N(C2CCC2)C1=O.CNC1CCCC(C)N(C2CCC3CC3C2)C1=O.CNC1CCCC(C)N(C2CCCC2)C1=O.CNC1CCCC(C)N(C2CCCCC2)C1=O.CNC1CCCC(C)N(C2CCCCCC2)C1=O.CNC1CCCC(C)N(CC2CC2)C1=O.CNC1CCCC(C)N(CC2CCC2)C1=O.CNC1CCCC(C)N(CC2CCC3CC32)C1=O.CNC1CCCC(C)N(CC2CCCC2)C1=O.CNC1CCCC(C)N(CC2CCCCC2)C1=O.CNC1CCCC(C)N(CC2CCCCCC2)C1=O
InChIInChI=1S/C16H28N2O.C16H30N2O.2C15H26N2O.2C15H28N2O.2C14H26N2O.C14H24N2O.2C13H24N2O.C13H22N2O.2C12H22N2O/c1-11-4-3-5-15(17-2)16(19)18(11)14-9-12-6-7-13(8-12)10-14;1-13-8-7-11-15(17-2)16(19)18(13)12-14-9-5-3-4-6-10-14;1-10-4-3-5-14(16-2)15(18)17(10)13-7-6-11-8-12(11)9-13;1-10-4-3-5-14(16-2)15(18)17(10)9-12-7-6-11-8-13(11)12;1-12-7-6-10-14(16-2)15(18)17(12)11-13-8-4-3-5-9-13;1-12-8-7-11-14(16-2)15(18)17(12)13-9-5-3-4-6-10-13;1-11-6-5-9-13(15-2)14(17)16(11)10-12-7-3-4-8-12;2*1-11-7-6-10-13(15-2)14(17)16(11)12-8-4-3-5-9-12;1-10-5-3-8-12(14-2)13(16)15(10)9-11-6-4-7-11;2*1-10-6-5-9-12(14-2)13(16)15(10)11-7-3-4-8-11;1-9-5-3-8-11(13-2)12(15)14(9)10-6-4-7-10;1-9-4-3-5-11(13-2)12(15)14(9)8-10-6-7-10/h11-15,17H,3-10H2,1-2H3;13-15,17H,3-12H2,1-2H3;2*10-14,16H,3-9H2,1-2H3;2*12-14,16H,3-11H2,1-2H3;2*11-13,15H,3-10H2,1-2H3;3-4,11-13,15H,5-10H2,1-2H3;2*10-12,14H,3-9H2,1-2H3;3-4,10-12,14H,5-9H2,1-2H3;2*9-11,13H,3-8H2,1-2H3
InChIKeyLUYUFHKXOQUMOP-UHFFFAOYSA-N
XLogP29.80
TPSA452.76 Ų
H-Bond Donors14
H-Bond Acceptors28
Rotatable Bonds34
Heavy Atoms239
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003341.20
LogP ≤ 529.80
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one?
The IUPAC name of 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one (CID 159464147) is 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one.
What is the SMILES notation for 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one?
The canonical SMILES for 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one is CNC1CCCC(C)N(C2CC3CCC(C3)C2)C1=O.CNC1CCCC(C)N(C2CC=CC2)C1=O.CNC1CCCC(C)N(C2CC=CCC2)C1=O.CNC1CCCC(C)N(C2CCC2)C1=O.CNC1CCCC(C)N(C2CCC3CC3C2)C1=O.CNC1CCCC(C)N(C2CCCC2)C1=O.CNC1CCCC(C)N(C2CCCCC2)C1=O.CNC1CCCC(C)N(C2CCCCCC2)C1=O.CNC1CCCC(C)N(CC2CC2)C1=O.CNC1CCCC(C)N(CC2CCC2)C1=O.CNC1CCCC(C)N(CC2CCC3CC32)C1=O.CNC1CCCC(C)N(CC2CCCC2)C1=O.CNC1CCCC(C)N(CC2CCCCC2)C1=O.CNC1CCCC(C)N(CC2CCCCCC2)C1=O.
What is the InChIKey of 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one?
The InChIKey is LUYUFHKXOQUMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O.C16H30N2O.2C15H26N2O.2C15H28N2O.2C14H26N2O.C14H24N2O.2C13H24N2O.C13H22N2O.2C12H22N2O/c1-11-4-3-5-15(17-2)16(19)18(11)14-9-12-6-7-13(8-12)10-14;1-13-8-7-11-15(17-2)16(19)18(13)12-14-9-5-3-4-6-10-14;1-10-4-3-5-14(16-2)15(18)17(10)13-7-6-11-8-12(11)9-13;1-10-4-3-5-14(16-2)15(18)17(10)9-12-7-6-11-8-13(11)12;1-12-7-6-10-14(16-2)15(18)17(12)11-13-8-4-3-5-9-13;1-12-8-7-11-14(16-2)15(18)17(12)13-9-5-3-4-6-10-13;1-11-6-5-9-13(15-2)14(17)16(11)10-12-7-3-4-8-12;2*1-11-7-6-10-13(15-2)14(17)16(11)12-8-4-3-5-9-12;1-10-5-3-8-12(14-2)13(16)15(10)9-11-6-4-7-11;2*1-10-6-5-9-12(14-2)13(16)15(10)11-7-3-4-8-11;1-9-5-3-8-11(13-2)12(15)14(9)10-6-4-7-10;1-9-4-3-5-11(13-2)12(15)14(9)8-10-6-7-10/h11-15,17H,3-10H2,1-2H3;13-15,17H,3-12H2,1-2H3;2*10-14,16H,3-9H2,1-2H3;2*12-14,16H,3-11H2,1-2H3;2*11-13,15H,3-10H2,1-2H3;3-4,11-13,15H,5-10H2,1-2H3;2*10-12,14H,3-9H2,1-2H3;3-4,10-12,14H,5-9H2,1-2H3;2*9-11,13H,3-8H2,1-2H3.
What are the key properties of 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one?
1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one has a molecular weight of 3341.20 g/mol, XLogP of 29.80, 34 rotatable bonds, 14 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bicyclo[4.1.0]heptanyl)-7-methyl-3-(methylamino)azepan-2-one;1-(2-bicyclo[3.1.0]hexanylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(3-bicyclo[3.2.1]octanyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclobutyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclobutylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cycloheptyl-7-methyl-3-(methylamino)azepan-2-one;1-(cycloheptylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclohex-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclohexyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclohexylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-cyclopent-3-en-1-yl-7-methyl-3-(methylamino)azepan-2-one;1-cyclopentyl-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopentylmethyl)-7-methyl-3-(methylamino)azepan-2-one;1-(cyclopropylmethyl)-7-methyl-3-(methylamino)azepan-2-one is sourced from PubChem (CID 159464147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).