1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide

C17H24N2O2 — CID 61253218

IUPAC1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide
SMILESCOc1ccc(C(NC(=O)C2(N)CCCC2)C2CC2)cc1
InChIInChI=1S/C17H24N2O2/c1-21-14-8-6-13(7-9-14)15(12-4-5-12)19-16(20)17(18)10-2-3-11-17/h6-9,12,15H,2-5,10-11,18H2,1H3,(H,19,20)
InChIKeySCZVMQLWSBWPOC-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.53
Rot. Bonds5

About 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide

1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide (PubChem CID 61253218) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide
PubChem CID61253218
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide
SMILESCOc1ccc(C(NC(=O)C2(N)CCCC2)C2CC2)cc1
InChIInChI=1S/C17H24N2O2/c1-21-14-8-6-13(7-9-14)15(12-4-5-12)19-16(20)17(18)10-2-3-11-17/h6-9,12,15H,2-5,10-11,18H2,1H3,(H,19,20)
InChIKeySCZVMQLWSBWPOC-UHFFFAOYSA-N
XLogP2.53
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]oxolane-3-carboxamide
CID 64891982
N-[cyclopropyl-(4-methoxyphenyl)methyl]acetamide
CID 60701170
N-[cyclopropyl-(4-methoxyphenyl)methyl]-2-methylpropanamide
CID 60701189
1-amino-N-[1-(4-methoxyphenyl)ethyl]cyclopropane-1-carboxamide;hydrochloride
CID 119706519
2-(aminomethyl)-N-[cyclopropyl-(4-methoxyphenyl)methyl]-3-methylbutanamide
CID 65229390
2-hydroxyethyl N-[cyclopropyl-(4-methoxyphenyl)methyl]carbamate
CID 79348785
3-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]butanamide
CID 61252828
1-amino-N-[(1R)-1-(4-methoxyphenyl)ethyl]-3-methylcyclohexane-1-carboxamide
CID 81368673
N-[cyclopropyl-(4-methoxyphenyl)methyl]hydroxylamine
CID 82684518
N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
CID 46566275
(2S)-2-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]butanamide;hydrochloride
CID 119275692
3-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 119697846

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide (CID 61253218) is 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide is COc1ccc(C(NC(=O)C2(N)CCCC2)C2CC2)cc1.
What is the InChIKey of 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide?
The InChIKey is SCZVMQLWSBWPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-14-8-6-13(7-9-14)15(12-4-5-12)19-16(20)17(18)10-2-3-11-17/h6-9,12,15H,2-5,10-11,18H2,1H3,(H,19,20).
What are the key properties of 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide?
1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 61253218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).