N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide

C113H206N10O10S — CID 160620570

IUPACN-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide
SMILESCC(C)CN(CC(C)C)C(=O)CCCCC(=O)N(CC(C)C)CC(C)C.CC(CCCC(=O)N(C)C1CCCCC1)C(=O)N(C)C1CCCCC1.CN(C(=O)CCCCC(=O)N(C)C1CCCCC1)C1CCCCC1.CN(C(=O)CCSCCC(=O)N(C)C1CCCCC1)C1CCCCC1.O=C(CCCCC(=O)N(C1CCCCC1)C1CCCCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C30H52N2O2.C22H44N2O2.C21H38N2O2.C20H36N2O2S.C20H36N2O2/c33-29(31(25-15-5-1-6-16-25)26-17-7-2-8-18-26)23-13-14-24-30(34)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-17(2)13-23(14-18(3)4)21(25)11-9-10-12-22(26)24(15-19(5)6)16-20(7)8;1-17(21(25)23(3)19-14-8-5-9-15-19)11-10-16-20(24)22(2)18-12-6-4-7-13-18;1-21(17-9-5-3-6-10-17)19(23)13-15-25-16-14-20(24)22(2)18-11-7-4-8-12-18;1-21(17-11-5-3-6-12-17)19(23)15-9-10-16-20(24)22(2)18-13-7-4-8-14-18/h25-28H,1-24H2;17-20H,9-16H2,1-8H3;17-19H,4-16H2,1-3H3;17-18H,3-16H2,1-2H3;17-18H,3-16H2,1-2H3
InChIKeyRGQKVFKCYPNPQO-UHFFFAOYSA-N
MW1897.02 g/mol
LogP24.95
Rot. Bonds44

About N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide

N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide (PubChem CID 160620570) has the molecular formula C113H206N10O10S and a molecular weight of 1897.02 g/mol. Its IUPAC name is N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide
PubChem CID160620570
Molecular FormulaC113H206N10O10S
Molecular Weight1897.02 g/mol
Exact Mass1895.56
IUPAC NameN-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide
SMILESCC(C)CN(CC(C)C)C(=O)CCCCC(=O)N(CC(C)C)CC(C)C.CC(CCCC(=O)N(C)C1CCCCC1)C(=O)N(C)C1CCCCC1.CN(C(=O)CCCCC(=O)N(C)C1CCCCC1)C1CCCCC1.CN(C(=O)CCSCCC(=O)N(C)C1CCCCC1)C1CCCCC1.O=C(CCCCC(=O)N(C1CCCCC1)C1CCCCC1)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C30H52N2O2.C22H44N2O2.C21H38N2O2.C20H36N2O2S.C20H36N2O2/c33-29(31(25-15-5-1-6-16-25)26-17-7-2-8-18-26)23-13-14-24-30(34)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-17(2)13-23(14-18(3)4)21(25)11-9-10-12-22(26)24(15-19(5)6)16-20(7)8;1-17(21(25)23(3)19-14-8-5-9-15-19)11-10-16-20(24)22(2)18-12-6-4-7-13-18;1-21(17-9-5-3-6-10-17)19(23)13-15-25-16-14-20(24)22(2)18-11-7-4-8-12-18;1-21(17-11-5-3-6-12-17)19(23)15-9-10-16-20(24)22(2)18-13-7-4-8-14-18/h25-28H,1-24H2;17-20H,9-16H2,1-8H3;17-19H,4-16H2,1-3H3;17-18H,3-16H2,1-2H3;17-18H,3-16H2,1-2H3
InChIKeyRGQKVFKCYPNPQO-UHFFFAOYSA-N
XLogP24.95
TPSA203.10 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds44
Heavy Atoms134
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001897.02
LogP ≤ 524.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide with MolForge

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Related Compounds

4-amino-N-cyclohexyl-N,2-dimethylbutanamide
CID 80542163
4-amino-N-cyclopentyl-N,2-dimethylbutanamide
CID 80542011
7-amino-N-cycloheptyl-N-methylheptanamide
CID 43614064
7-amino-N-cyclooctyl-N-methylheptanamide
CID 119763844
5-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylhexanamide
CID 82850535
6-amino-N-cyclopentyl-N-methylhexanamide
CID 43267226
3-[3-[bis(2-methylpropyl)amino]-3-oxopropyl]sulfanyl-N,N-bis(2-methylpropyl)propanamide;N,N-di(butan-2-yl)-3-[3-[di(butan-2-yl)amino]-3-oxopropyl]sulfanylpropanamide;N,N,N',N'-tetra(butan-2-yl)decanediamide;N,N,N',N'-tetraethyldecanediamide;N,N,N',N'-tetrakis(2-methylpropyl)decanediamide;N,N,N',N'-tetrakis(prop-2-enyl)decanediamide
CID 158196466
2-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-(2-methylpropyl)amino]acetic acid
CID 63066641
N-cyclohexyl-4-methoxy-N-(2-methylpropyl)butanamide
CID 145047882
N-cycloheptyl-2-hydroxy-N-methylacetamide
CID 130678772
2-amino-N-cyclooctyl-N-methylpropanamide
CID 83630474
N,4-dicyclohexyl-N-methyl-4-thionitrosobutanamide
CID 89026512

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide?
The IUPAC name of N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide (CID 160620570) is N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide.
What is the SMILES notation for N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide?
The canonical SMILES for N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide is CC(C)CN(CC(C)C)C(=O)CCCCC(=O)N(CC(C)C)CC(C)C.CC(CCCC(=O)N(C)C1CCCCC1)C(=O)N(C)C1CCCCC1.CN(C(=O)CCCCC(=O)N(C)C1CCCCC1)C1CCCCC1.CN(C(=O)CCSCCC(=O)N(C)C1CCCCC1)C1CCCCC1.O=C(CCCCC(=O)N(C1CCCCC1)C1CCCCC1)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide?
The InChIKey is RGQKVFKCYPNPQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H52N2O2.C22H44N2O2.C21H38N2O2.C20H36N2O2S.C20H36N2O2/c33-29(31(25-15-5-1-6-16-25)26-17-7-2-8-18-26)23-13-14-24-30(34)32(27-19-9-3-10-20-27)28-21-11-4-12-22-28;1-17(2)13-23(14-18(3)4)21(25)11-9-10-12-22(26)24(15-19(5)6)16-20(7)8;1-17(21(25)23(3)19-14-8-5-9-15-19)11-10-16-20(24)22(2)18-12-6-4-7-13-18;1-21(17-9-5-3-6-10-17)19(23)13-15-25-16-14-20(24)22(2)18-11-7-4-8-12-18;1-21(17-11-5-3-6-12-17)19(23)15-9-10-16-20(24)22(2)18-13-7-4-8-14-18/h25-28H,1-24H2;17-20H,9-16H2,1-8H3;17-19H,4-16H2,1-3H3;17-18H,3-16H2,1-2H3;17-18H,3-16H2,1-2H3.
What are the key properties of N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide?
N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide has a molecular weight of 1897.02 g/mol, XLogP of 24.95, 44 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[3-[cyclohexyl(methyl)amino]-3-oxopropyl]sulfanyl-N-methylpropanamide;N,N'-dicyclohexyl-N,N'-dimethylhexanediamide;N,N'-dicyclohexyl-N,N',2-trimethylhexanediamide;N,N,N',N'-tetracyclohexylhexanediamide;N,N,N',N'-tetrakis(2-methylpropyl)hexanediamide is sourced from PubChem (CID 160620570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).