2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide

C15H28N2O — CID 62781685

IUPAC2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide
SMILESCC1CCCC(NC(=O)CC2CCC(N)CC2)C1
InChIInChI=1S/C15H28N2O/c1-11-3-2-4-14(9-11)17-15(18)10-12-5-7-13(16)8-6-12/h11-14H,2-10,16H2,1H3,(H,17,18)
InChIKeyDODMVKNJDDKGII-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.59
Rot. Bonds3

About 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide

2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide (PubChem CID 62781685) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide
PubChem CID62781685
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide
SMILESCC1CCCC(NC(=O)CC2CCC(N)CC2)C1
InChIInChI=1S/C15H28N2O/c1-11-3-2-4-14(9-11)17-15(18)10-12-5-7-13(16)8-6-12/h11-14H,2-10,16H2,1H3,(H,17,18)
InChIKeyDODMVKNJDDKGII-UHFFFAOYSA-N
XLogP2.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminocyclohexyl)-2-cyclopropylacetamide
CID 83619282
N-(3-aminocyclopentyl)-2-cyclopentylacetamide
CID 115272899
3-[(3-methylcyclohexyl)amino]-3-oxopropanoic acid
CID 62229888
2-(4-aminocyclohexyl)-N-(1-methylpiperidin-3-yl)acetamide
CID 62781090
2-(4-aminocyclohexyl)-N-(4-ethylcyclohexyl)acetamide
CID 62782919
N-cyclopentyl-2-cyclopropylacetamide
CID 60753480
2-(4-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777737
7-amino-N-(3-methylcyclohexyl)heptanamide
CID 43317968
4-amino-3-methyl-N-(3-methylcyclohexyl)butanamide
CID 81071155
N-[(3S)-3-methylcyclohexyl]acetamide
CID 143244343
(3-methylcyclohexyl)carbamic acid
CID 67410451
2-cyclobutyl-N-(2-methylpiperidin-4-yl)acetamide;hydrochloride
CID 120599149

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide?
The IUPAC name of 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide (CID 62781685) is 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide is CC1CCCC(NC(=O)CC2CCC(N)CC2)C1.
What is the InChIKey of 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide?
The InChIKey is DODMVKNJDDKGII-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-11-3-2-4-14(9-11)17-15(18)10-12-5-7-13(16)8-6-12/h11-14H,2-10,16H2,1H3,(H,17,18).
What are the key properties of 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide?
2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide has a molecular weight of 252.40 g/mol, XLogP of 2.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminocyclohexyl)-N-(3-methylcyclohexyl)acetamide is sourced from PubChem (CID 62781685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).