2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide

C14H28N2O — CID 79878464

IUPAC2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide
SMILESCC(C)CC(N)C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C14H28N2O/c1-10(2)9-11(15)13(17)16-12-7-5-6-8-14(12,3)4/h10-12H,5-9,15H2,1-4H3,(H,16,17)
InChIKeyOPIFZMTZCZOVMW-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.44
Rot. Bonds4

About 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide

2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide (PubChem CID 79878464) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide
PubChem CID79878464
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide
SMILESCC(C)CC(N)C(=O)NC1CCCCC1(C)C
InChIInChI=1S/C14H28N2O/c1-10(2)9-11(15)13(17)16-12-7-5-6-8-14(12,3)4/h10-12H,5-9,15H2,1-4H3,(H,16,17)
InChIKeyOPIFZMTZCZOVMW-UHFFFAOYSA-N
XLogP2.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-(2,2-dimethylcyclohexyl)butanamide
CID 79878292
2-amino-N-(2,2-dimethylcyclohexyl)pentanamide
CID 79877969
4-amino-5-[(2,2-dimethylcyclohexyl)amino]-5-oxopentanoic acid
CID 79878132
(2S)-2-amino-N-(2,2-dimethylcyclopentyl)hexanamide
CID 103831777
(3S)-3-(aminomethyl)-N-(2,2-dimethylcyclohexyl)-5-methylhexanamide
CID 79878962
4-amino-N-(2,2-dimethylcyclohexyl)pentanamide;hydrochloride
CID 120562889
(2R)-2-amino-N-(3-hydroxy-2,2-dimethylcyclobutyl)-4-methylpentanamide
CID 104940467
2-cyano-N-(2,2-dimethylcyclohexyl)propanamide
CID 79877982
3-(aminomethyl)-N-(2,2-dimethylcyclopentyl)-5-methylhexanamide
CID 79878870
2-[[(2R)-2-amino-4-methylpentanoyl]amino]cyclohexane-1-carboxylic acid
CID 103869669
(2S)-2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-4-methylpentanamide
CID 103812819
N-(2,2-dimethylcyclohexyl)-2-(N'-hydroxycarbamimidoyl)butanamide
CID 79872938

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide?
The IUPAC name of 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide (CID 79878464) is 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide.
What is the SMILES notation for 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide?
The canonical SMILES for 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide is CC(C)CC(N)C(=O)NC1CCCCC1(C)C.
What is the InChIKey of 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide?
The InChIKey is OPIFZMTZCZOVMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-10(2)9-11(15)13(17)16-12-7-5-6-8-14(12,3)4/h10-12H,5-9,15H2,1-4H3,(H,16,17).
What are the key properties of 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide?
2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide has a molecular weight of 240.39 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-dimethylcyclohexyl)-4-methylpentanamide is sourced from PubChem (CID 79878464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).