2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide

C17H26N2O — CID 64732725

IUPAC2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide
SMILESCC1CC(C)CC(NC(=O)C(C)(N)c2ccccc2)C1
InChIInChI=1S/C17H26N2O/c1-12-9-13(2)11-15(10-12)19-16(20)17(3,18)14-7-5-4-6-8-14/h4-8,12-13,15H,9-11,18H2,1-3H3,(H,19,20)
InChIKeyHRNGLORTUAYSDB-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.80
Rot. Bonds3

About 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide

2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide (PubChem CID 64732725) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide
PubChem CID64732725
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide
SMILESCC1CC(C)CC(NC(=O)C(C)(N)c2ccccc2)C1
InChIInChI=1S/C17H26N2O/c1-12-9-13(2)11-15(10-12)19-16(20)17(3,18)14-7-5-4-6-8-14/h4-8,12-13,15H,9-11,18H2,1-3H3,(H,19,20)
InChIKeyHRNGLORTUAYSDB-UHFFFAOYSA-N
XLogP2.80
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,3R)-3-[(2-amino-2-phenylpropanoyl)amino]cyclohexane-1-carboxylic acid
CID 146109351
2-amino-N-cycloheptyl-2-phenylpropanamide;hydrochloride
CID 120586523
2-amino-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-2-phenylpropanamide
CID 120597505
2-amino-N-[3-(dimethylamino)cyclohexyl]-2-phenylpropanamide
CID 120597033
2-amino-2-phenyl-N-(1-phenylpiperidin-4-yl)propanamide
CID 120595916
2-amino-N-(5-oxopyrrolidin-3-yl)-2-phenylpropanamide
CID 106187568
2-amino-N-(2-methyloxolan-3-yl)-2-phenylpropanamide
CID 82729111
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)-2-phenylpropanamide
CID 62487733
2-amino-N-(1-methylsulfonylpiperidin-4-yl)-2-phenylpropanamide;hydrochloride
CID 120587710
2-amino-2-phenyl-N-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]propanamide
CID 122084249
2-amino-N-(2,3-dimethylcyclohexyl)-2-phenylpropanamide;hydrochloride
CID 120607906
2-bromo-2-methyl-N-(3-methylcyclobutyl)propanamide
CID 114329140

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide?
The IUPAC name of 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide (CID 64732725) is 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide is CC1CC(C)CC(NC(=O)C(C)(N)c2ccccc2)C1.
What is the InChIKey of 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide?
The InChIKey is HRNGLORTUAYSDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12-9-13(2)11-15(10-12)19-16(20)17(3,18)14-7-5-4-6-8-14/h4-8,12-13,15H,9-11,18H2,1-3H3,(H,19,20).
What are the key properties of 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide?
2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-dimethylcyclohexyl)-2-phenylpropanamide is sourced from PubChem (CID 64732725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).