3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine

C135H286N20O8 — CID 164981755

IUPAC3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine
SMILESC.CC.CC.CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1CC2(COC2)C1.CC(C)(C)N1CC2CC1CN2.CC(C)(C)N1CC2CC1CO2.CC(C)(C)N1CC2CCC(C2)C1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCOCC1.CC(C)(C)NCCN1CCOCC1.CN(CCN1CCOCC1)C(C)(C)C.CN1CC2(C1)CN(C(C)(C)C)C2.CN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.COCCN(C)C(C)(C)C
InChIInChI=1S/C11H24N2O.C11H21N.C10H22N2O.C10H20N2.C10H19NO.C9H18N2.2C9H20N2.2C9H17NO.C9H19N.2C8H17NO.C8H19NO.2C2H6.CH4/c1-11(2,3)12(4)5-6-13-7-9-14-10-8-13;1-11(2,3)12-7-9-4-5-10(6-9)8-12;1-10(2,3)11-4-5-12-6-8-13-9-7-12;1-9(2,3)12-7-10(8-12)5-11(4)6-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-9(2,3)11-6-7-4-8(11)5-10-7;2*1-9(2,3)11-7-5-10(4)6-8-11;1-8(2,3)10-4-9(5-10)6-11-7-9;1-9(2,3)10-5-8-4-7(10)6-11-8;1-9(2,3)10-7-5-4-6-8-10;2*1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9(4)6-7-10-5;2*1-2;/h5-10H2,1-4H3;9-10H,4-8H2,1-3H3;11H,4-9H2,1-3H3;5-8H2,1-4H3;8-9H,4-7H2,1-3H3;7-8,10H,4-6H2,1-3H3;2*5-8H2,1-4H3;4-7H2,1-3H3;7-8H,4-6H2,1-3H3;4-8H2,1-3H3;2*4-7H2,1-3H3;6-7H2,1-5H3;2*1-2H3;1H4
InChIKeyFPAOPLZGAYSRNV-UHFFFAOYSA-N
MW2317.90 g/mol
LogP20.78
Rot. Bonds9

About 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine

3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine (PubChem CID 164981755) has the molecular formula C135H286N20O8 and a molecular weight of 2317.90 g/mol. Its IUPAC name is 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine.

Molecular Properties

Compound Name3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine
PubChem CID164981755
Molecular FormulaC135H286N20O8
Molecular Weight2317.90 g/mol
Exact Mass2316.26
IUPAC Name3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine
SMILESC.CC.CC.CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1CC2(COC2)C1.CC(C)(C)N1CC2CC1CN2.CC(C)(C)N1CC2CC1CO2.CC(C)(C)N1CC2CCC(C2)C1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCOCC1.CC(C)(C)NCCN1CCOCC1.CN(CCN1CCOCC1)C(C)(C)C.CN1CC2(C1)CN(C(C)(C)C)C2.CN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.COCCN(C)C(C)(C)C
InChIInChI=1S/C11H24N2O.C11H21N.C10H22N2O.C10H20N2.C10H19NO.C9H18N2.2C9H20N2.2C9H17NO.C9H19N.2C8H17NO.C8H19NO.2C2H6.CH4/c1-11(2,3)12(4)5-6-13-7-9-14-10-8-13;1-11(2,3)12-7-9-4-5-10(6-9)8-12;1-10(2,3)11-4-5-12-6-8-13-9-7-12;1-9(2,3)12-7-10(8-12)5-11(4)6-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-9(2,3)11-6-7-4-8(11)5-10-7;2*1-9(2,3)11-7-5-10(4)6-8-11;1-8(2,3)10-4-9(5-10)6-11-7-9;1-9(2,3)10-5-8-4-7(10)6-11-8;1-9(2,3)10-7-5-4-6-8-10;2*1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9(4)6-7-10-5;2*1-2;/h5-10H2,1-4H3;9-10H,4-8H2,1-3H3;11H,4-9H2,1-3H3;5-8H2,1-4H3;8-9H,4-7H2,1-3H3;7-8,10H,4-6H2,1-3H3;2*5-8H2,1-4H3;4-7H2,1-3H3;7-8H,4-6H2,1-3H3;4-8H2,1-3H3;2*4-7H2,1-3H3;6-7H2,1-5H3;2*1-2H3;1H4
InChIKeyFPAOPLZGAYSRNV-UHFFFAOYSA-N
XLogP20.78
TPSA156.22 Ų
H-Bond Donors2
H-Bond Acceptors28
Rotatable Bonds9
Heavy Atoms163
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002317.90
LogP ≤ 520.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1028

Analyze 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine?
The IUPAC name of 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine (CID 164981755) is 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine.
What is the SMILES notation for 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine?
The canonical SMILES for 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine is C.CC.CC.CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1CC2(COC2)C1.CC(C)(C)N1CC2CC1CN2.CC(C)(C)N1CC2CC1CO2.CC(C)(C)N1CC2CCC(C2)C1.CC(C)(C)N1CCCCC1.CC(C)(C)N1CCOCC1.CC(C)(C)N1CCOCC1.CC(C)(C)NCCN1CCOCC1.CN(CCN1CCOCC1)C(C)(C)C.CN1CC2(C1)CN(C(C)(C)C)C2.CN1CCN(C(C)(C)C)CC1.CN1CCN(C(C)(C)C)CC1.COCCN(C)C(C)(C)C.
What is the InChIKey of 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine?
The InChIKey is FPAOPLZGAYSRNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O.C11H21N.C10H22N2O.C10H20N2.C10H19NO.C9H18N2.2C9H20N2.2C9H17NO.C9H19N.2C8H17NO.C8H19NO.2C2H6.CH4/c1-11(2,3)12(4)5-6-13-7-9-14-10-8-13;1-11(2,3)12-7-9-4-5-10(6-9)8-12;1-10(2,3)11-4-5-12-6-8-13-9-7-12;1-9(2,3)12-7-10(8-12)5-11(4)6-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-9(2,3)11-6-7-4-8(11)5-10-7;2*1-9(2,3)11-7-5-10(4)6-8-11;1-8(2,3)10-4-9(5-10)6-11-7-9;1-9(2,3)10-5-8-4-7(10)6-11-8;1-9(2,3)10-7-5-4-6-8-10;2*1-8(2,3)9-4-6-10-7-5-9;1-8(2,3)9(4)6-7-10-5;2*1-2;/h5-10H2,1-4H3;9-10H,4-8H2,1-3H3;11H,4-9H2,1-3H3;5-8H2,1-4H3;8-9H,4-7H2,1-3H3;7-8,10H,4-6H2,1-3H3;2*5-8H2,1-4H3;4-7H2,1-3H3;7-8H,4-6H2,1-3H3;4-8H2,1-3H3;2*4-7H2,1-3H3;6-7H2,1-5H3;2*1-2H3;1H4.
What are the key properties of 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine?
3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine has a molecular weight of 2317.90 g/mol, XLogP of 20.78, 9 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-3-azabicyclo[3.2.1]octane;2-tert-butyl-2,5-diazabicyclo[2.2.1]heptane;2-tert-butyl-6-methyl-2,6-diazaspiro[3.3]heptane;bis(1-tert-butyl-4-methylpiperazine);bis(4-tert-butylmorpholine);5-tert-butyl-2-oxa-5-azabicyclo[2.2.1]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6-tert-butyl-2-oxa-6-azaspiro[3.3]heptane;1-tert-butylpiperidine;N,2-dimethyl-N-(2-morpholin-4-ylethyl)propan-2-amine;ethane;methane;N-(2-methoxyethyl)-N,2-dimethylpropan-2-amine;2-methyl-N-(2-morpholin-4-ylethyl)propan-2-amine is sourced from PubChem (CID 164981755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).