N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide

C16H22N2O — CID 63753599

IUPACN-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide
SMILESNCC1(NC(=O)C2(c3ccccc3)CC2)CCCC1
InChIInChI=1S/C16H22N2O/c17-12-15(8-4-5-9-15)18-14(19)16(10-11-16)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12,17H2,(H,18,19)
InChIKeyAWGHKZDUNZKPDU-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.11
Rot. Bonds4

About N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide

N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide (PubChem CID 63753599) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide
PubChem CID63753599
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide
SMILESNCC1(NC(=O)C2(c3ccccc3)CC2)CCCC1
InChIInChI=1S/C16H22N2O/c17-12-15(8-4-5-9-15)18-14(19)16(10-11-16)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12,17H2,(H,18,19)
InChIKeyAWGHKZDUNZKPDU-UHFFFAOYSA-N
XLogP2.11
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(aminomethyl)oxan-4-yl]-1-phenylcyclopropane-1-carboxamide
CID 106297128
N-[1-(hydroxymethyl)cyclohexyl]-1-phenylcyclopropane-1-carboxamide
CID 62521476
N-[1-(chloromethyl)cyclohexyl]-1-phenylcyclopropane-1-carboxamide
CID 114303546
2-[1-[(1-phenylcyclopropanecarbonyl)amino]cyclobutyl]acetic acid
CID 79846404
N-[[1-(aminomethyl)cyclohexyl]methyl]-1-phenylcyclopropane-1-carboxamide
CID 103970193
N-[1-(aminomethyl)cyclopentyl]-2-(4-phenylphenyl)acetamide
CID 119564798
N-(1-carbamothioylcyclohexyl)-1-phenylcyclopropane-1-carboxamide
CID 62881411
1-[(1-phenylcyclobutanecarbonyl)amino]cyclopentane-1-carboxylic acid
CID 43360266
N-[1-(aminomethyl)cyclohexyl]-2-phenoxyacetamide
CID 63755837
N-[(2S)-1-aminopropan-2-yl]-1-phenylcyclopentane-1-carboxamide
CID 120505049
N-[3-(aminomethyl)pentan-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 63765721
N-ethyl-1-phenylcyclopentane-1-carboxamide
CID 778764

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide (CID 63753599) is N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide is NCC1(NC(=O)C2(c3ccccc3)CC2)CCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide?
The InChIKey is AWGHKZDUNZKPDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c17-12-15(8-4-5-9-15)18-14(19)16(10-11-16)13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12,17H2,(H,18,19).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide?
N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide has a molecular weight of 258.36 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 63753599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).