3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide

C16H24N2O — CID 80552093

IUPAC3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide
SMILESCC(C(=O)NC1(C)CCCC1)C(N)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-12(14(17)13-8-4-3-5-9-13)15(19)18-16(2)10-6-7-11-16/h3-5,8-9,12,14H,6-7,10-11,17H2,1-2H3,(H,18,19)
InChIKeyHXAMIMINCZIKNA-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.77
Rot. Bonds4

About 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide

3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide (PubChem CID 80552093) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide.

Molecular Properties

Compound Name3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide
PubChem CID80552093
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide
SMILESCC(C(=O)NC1(C)CCCC1)C(N)c1ccccc1
InChIInChI=1S/C16H24N2O/c1-12(14(17)13-8-4-3-5-9-13)15(19)18-16(2)10-6-7-11-16/h3-5,8-9,12,14H,6-7,10-11,17H2,1-2H3,(H,18,19)
InChIKeyHXAMIMINCZIKNA-UHFFFAOYSA-N
XLogP2.77
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3-amino-2-methyl-3-phenylpropanoyl)amino]cyclohexane-1-carboxamide
CID 119735685
methyl 1-[(3-amino-2-methyl-3-phenylpropanoyl)amino]cyclohexane-1-carboxylate;hydrochloride
CID 119701267
2-amino-N-(1-methylcyclopropyl)-2-phenylacetamide
CID 115747036
2-cyano-N-(1-methylcyclobutyl)-2-phenylacetamide
CID 113485501
1-[[(3-amino-2-methyl-3-phenylpropanoyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 115445799
3-amino-2-methyl-3-phenyl-N-[(1-propylcyclobutyl)methyl]propanamide;hydrochloride
CID 119821711
3-amino-N-(1-methylcyclohexyl)-3-phenylpropanamide;hydrochloride
CID 119950222
3-amino-N-carbamoyl-2-methyl-3-phenylpropanamide
CID 80552689
2,3-dimethyl-4-[(1-methylcyclopentyl)amino]-4-oxobutanoic acid
CID 103498024
3-amino-2-methyl-3-phenyl-N-(1-phenylethyl)propanamide;hydrochloride
CID 119669700
3-amino-N-(1-cyclopentylethyl)-2-methyl-3-phenylpropanamide
CID 80552136
3-amino-N-[[1-(2-methoxyethyl)cyclobutyl]methyl]-2-methyl-3-phenylpropanamide;hydrochloride
CID 119820368

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide?
The IUPAC name of 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide (CID 80552093) is 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide.
What is the SMILES notation for 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide?
The canonical SMILES for 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide is CC(C(=O)NC1(C)CCCC1)C(N)c1ccccc1.
What is the InChIKey of 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide?
The InChIKey is HXAMIMINCZIKNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-12(14(17)13-8-4-3-5-9-13)15(19)18-16(2)10-6-7-11-16/h3-5,8-9,12,14H,6-7,10-11,17H2,1-2H3,(H,18,19).
What are the key properties of 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide?
3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide has a molecular weight of 260.38 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-(1-methylcyclopentyl)-3-phenylpropanamide is sourced from PubChem (CID 80552093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).