1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide

C15H28N2O — CID 64909548

IUPAC1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide
SMILESCC1CCCC(N)(C(=O)NC2CCC(C)C2C)C1
InChIInChI=1S/C15H28N2O/c1-10-5-4-8-15(16,9-10)14(18)17-13-7-6-11(2)12(13)3/h10-13H,4-9,16H2,1-3H3,(H,17,18)
InChIKeyBOJMZMAIDMCGDK-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.44
Rot. Bonds2

About 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide

1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide (PubChem CID 64909548) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide
PubChem CID64909548
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide
SMILESCC1CCCC(N)(C(=O)NC2CCC(C)C2C)C1
InChIInChI=1S/C15H28N2O/c1-10-5-4-8-15(16,9-10)14(18)17-13-7-6-11(2)12(13)3/h10-13H,4-9,16H2,1-3H3,(H,17,18)
InChIKeyBOJMZMAIDMCGDK-UHFFFAOYSA-N
XLogP2.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-amino-3-methyl-N-(2-methylcyclopentyl)cyclohexane-1-carboxamide
CID 64553819
1-amino-N-(2-hydroxycyclohexyl)-3-methylcyclohexane-1-carboxamide
CID 64552758
1-amino-N-cyclopentyl-3-methylcyclohexane-1-carboxamide
CID 64548983
1-amino-N-hydroxy-3-methylcyclohexane-1-carboxamide
CID 64555298
1-amino-N-(4,4-dimethylcyclohexyl)-3-methylcyclohexane-1-carboxamide
CID 64554668
1-amino-N-ethyl-3-methylcyclohexane-1-carboxamide
CID 64549188
1-amino-N-(2,4-dimethylcyclohexyl)cyclobutane-1-carboxamide
CID 81169428
cis-(1S,3S)-1-amino-3-methylcyclohexane-1-carboxamide
CID 93311266
1-amino-N-(cyclobutylmethyl)-3-methylcyclohexane-1-carboxamide
CID 64550637
1-amino-N-(1,1-dioxothian-3-yl)-3-methylcyclohexane-1-carboxamide
CID 64554877
trans-methyl (1R,3S)-1-amino-3-methylcyclohexane-1-carboxylate
CID 93311018
trans-methyl (1S,3R)-1-amino-3-methylcyclohexane-1-carboxylate
CID 93311019

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide?
The IUPAC name of 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide (CID 64909548) is 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide is CC1CCCC(N)(C(=O)NC2CCC(C)C2C)C1.
What is the InChIKey of 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide?
The InChIKey is BOJMZMAIDMCGDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-10-5-4-8-15(16,9-10)14(18)17-13-7-6-11(2)12(13)3/h10-13H,4-9,16H2,1-3H3,(H,17,18).
What are the key properties of 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide?
1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(2,3-dimethylcyclopentyl)-3-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 64909548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).