3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide

C16H30N2O — CID 62776840

IUPAC3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide
SMILESCCC(NC(=O)C1CCCC(N)C1)C1CCCCC1
InChIInChI=1S/C16H30N2O/c1-2-15(12-7-4-3-5-8-12)18-16(19)13-9-6-10-14(17)11-13/h12-15H,2-11,17H2,1H3,(H,18,19)
InChIKeyLGNKOKIGVVUWBJ-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.98
Rot. Bonds4

About 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide

3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide (PubChem CID 62776840) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide
PubChem CID62776840
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide
SMILESCCC(NC(=O)C1CCCC(N)C1)C1CCCCC1
InChIInChI=1S/C16H30N2O/c1-2-15(12-7-4-3-5-8-12)18-16(19)13-9-6-10-14(17)11-13/h12-15H,2-11,17H2,1H3,(H,18,19)
InChIKeyLGNKOKIGVVUWBJ-UHFFFAOYSA-N
XLogP2.98
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide
CID 119809033
3-amino-N-(3-cyclohexylbutan-2-yl)cyclopentane-1-carboxamide;hydrochloride
CID 119809032
(2S,3S)-2-[(3-aminocyclohexanecarbonyl)amino]-3-methylpentanoic acid
CID 63044886
ethyl 2-[(3-aminocyclohexanecarbonyl)amino]-3-methylpentanoate
CID 119808262
N-(1-cyclohexylpropyl)acetamide
CID 45119320
3-amino-N-(1-cyclopentylethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119782445
4-amino-N-(1-cyclohexylpropyl)oxolane-3-carboxamide
CID 66237697
methyl (2S)-2-[(3-aminocyclohexanecarbonyl)amino]propanoate
CID 63044300
1-cyclohexylpropylthiourea
CID 62407553
3-amino-N-(2-hydroxy-3-methylpentyl)cyclohexane-1-carboxamide;hydrochloride
CID 119784027
N-(1-cyclobutylpropyl)acetamide
CID 127002620
3-amino-N-but-3-en-2-ylcyclohexane-1-carboxamide
CID 115739612

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide (CID 62776840) is 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide is CCC(NC(=O)C1CCCC(N)C1)C1CCCCC1.
What is the InChIKey of 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide?
The InChIKey is LGNKOKIGVVUWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-15(12-7-4-3-5-8-12)18-16(19)13-9-6-10-14(17)11-13/h12-15H,2-11,17H2,1H3,(H,18,19).
What are the key properties of 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide?
3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.98, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-cyclohexylpropyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 62776840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).