N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide

C15H21N3O — CID 79462712

IUPACN-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide
SMILESNC1CCC(Nc2cccc(NC(=O)C3CC3)c2)C1
InChIInChI=1S/C15H21N3O/c16-11-6-7-14(8-11)17-12-2-1-3-13(9-12)18-15(19)10-4-5-10/h1-3,9-11,14,17H,4-8,16H2,(H,18,19)
InChIKeyQCQMBMAYTVQUET-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.33
Rot. Bonds4

About N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide

N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide (PubChem CID 79462712) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide
PubChem CID79462712
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC NameN-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide
SMILESNC1CCC(Nc2cccc(NC(=O)C3CC3)c2)C1
InChIInChI=1S/C15H21N3O/c16-11-6-7-14(8-11)17-12-2-1-3-13(9-12)18-15(19)10-4-5-10/h1-3,9-11,14,17H,4-8,16H2,(H,18,19)
InChIKeyQCQMBMAYTVQUET-UHFFFAOYSA-N
XLogP2.33
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(4-hydroxycyclohexyl)amino]phenyl]cyclopropanecarboxamide
CID 106593465
N-[3-(cyclohexylamino)phenyl]cyclopropanecarboxamide
CID 28620674
tert-butyl N-[3-[(3-aminocyclopentyl)amino]phenyl]carbamate
CID 107239958
cis-(1S,3R)-3-amino-N-(3-phenylphenyl)cyclopentane-1-carboxamide
CID 56906171
N-(4-aminocyclohexyl)-3-(cyclopropanecarbonylamino)benzamide
CID 119477045
methyl N-[3-[(3-aminocyclohexyl)amino]phenyl]carbamate
CID 79459255
3-amino-N-(3-pyrrol-1-ylphenyl)cyclopentane-1-carboxamide
CID 66010193
3-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
CID 79461660
4-fluoro-N-[3-[(4-fluorocyclohexanecarbonyl)amino]phenyl]cyclohexane-1-carboxamide
CID 171577056
4-amino-N-(3-propan-2-ylphenyl)cyclohexane-1-carboxamide
CID 60848284
4-amino-N-(3-methoxyphenyl)cyclohexane-1-carboxamide
CID 60848992
3-amino-N-[3-(methylsulfamoyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119731804

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide (CID 79462712) is N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide is NC1CCC(Nc2cccc(NC(=O)C3CC3)c2)C1.
What is the InChIKey of N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide?
The InChIKey is QCQMBMAYTVQUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c16-11-6-7-14(8-11)17-12-2-1-3-13(9-12)18-15(19)10-4-5-10/h1-3,9-11,14,17H,4-8,16H2,(H,18,19).
What are the key properties of N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide?
N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.33, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-aminocyclopentyl)amino]phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 79462712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).