2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide

C17H24N2O — CID 115055999

IUPAC2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide
SMILESCC(C(=O)NC1CCCC1)c1ccc(C2(N)CC2)cc1
InChIInChI=1S/C17H24N2O/c1-12(16(20)19-15-4-2-3-5-15)13-6-8-14(9-7-13)17(18)10-11-17/h6-9,12,15H,2-5,10-11,18H2,1H3,(H,19,20)
InChIKeyAIICBQUGOSMHBN-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.80
Rot. Bonds4

About 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide

2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide (PubChem CID 115055999) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide.

Molecular Properties

Compound Name2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide
PubChem CID115055999
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide
SMILESCC(C(=O)NC1CCCC1)c1ccc(C2(N)CC2)cc1
InChIInChI=1S/C17H24N2O/c1-12(16(20)19-15-4-2-3-5-15)13-6-8-14(9-7-13)17(18)10-11-17/h6-9,12,15H,2-5,10-11,18H2,1H3,(H,19,20)
InChIKeyAIICBQUGOSMHBN-UHFFFAOYSA-N
XLogP2.80
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[3-(1-aminocyclopropyl)phenyl]-N-cyclopentyl-2-methylpropanamide
CID 115055777
2-(3-aminophenyl)-N-cyclopropylpropanamide
CID 106590663
(2S)-N-cyclopentyl-3-hydroxy-2-(2-phenylpropanoylamino)propanamide
CID 6667454
methyl 4-(2-phenylpropanoylamino)cyclohexane-1-carboxylate
CID 104917471
2-[4-(3-aminooxetan-3-yl)phenyl]-2-cyclopentylacetic acid
CID 130407751
N-cyclopentyl-2-(4-fluorophenyl)-3-methylbutanamide
CID 110316813
2-(3-bromophenyl)-N-cyclopropylpropanamide
CID 176514290
cis-(1S,3R)-3-[[(2S)-2-phenylpropanoyl]amino]cyclopentane-1-carboxylic acid
CID 120690493
2-(4-chlorophenyl)-N-cyclopentyl-3-methylbutanamide
CID 60631278
4-propan-2-yl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
CID 55186583
N-[2-(cyclopropylamino)ethyl]-2-(4-methylphenyl)propanamide
CID 91645347
2-amino-N-cyclopentyl-2-cyclopropylacetamide
CID 130870089

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide?
The IUPAC name of 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide (CID 115055999) is 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide.
What is the SMILES notation for 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide?
The canonical SMILES for 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide is CC(C(=O)NC1CCCC1)c1ccc(C2(N)CC2)cc1.
What is the InChIKey of 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide?
The InChIKey is AIICBQUGOSMHBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-12(16(20)19-15-4-2-3-5-15)13-6-8-14(9-7-13)17(18)10-11-17/h6-9,12,15H,2-5,10-11,18H2,1H3,(H,19,20).
What are the key properties of 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide?
2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide has a molecular weight of 272.39 g/mol, XLogP of 2.80, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-aminocyclopropyl)phenyl]-N-cyclopentylpropanamide is sourced from PubChem (CID 115055999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).