2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide

C14H19N3O2 — CID 115434729

IUPAC2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide
SMILESNCC1(C(=O)Nc2ccccc2C(N)=O)CCCC1
InChIInChI=1S/C14H19N3O2/c15-9-14(7-3-4-8-14)13(19)17-11-6-2-1-5-10(11)12(16)18/h1-2,5-6H,3-4,7-9,15H2,(H2,16,18)(H,17,19)
InChIKeyHSNMXYLSMFBGTB-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.24
Rot. Bonds4

About 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide

2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide (PubChem CID 115434729) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide.

Molecular Properties

Compound Name2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide
PubChem CID115434729
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide
SMILESNCC1(C(=O)Nc2ccccc2C(N)=O)CCCC1
InChIInChI=1S/C14H19N3O2/c15-9-14(7-3-4-8-14)13(19)17-11-6-2-1-5-10(11)12(16)18/h1-2,5-6H,3-4,7-9,15H2,(H2,16,18)(H,17,19)
InChIKeyHSNMXYLSMFBGTB-UHFFFAOYSA-N
XLogP1.24
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-(2-carbamoylphenyl)cycloheptane-1-carboxamide
CID 115443739
4-(aminomethyl)-N-(2-carbamoylphenyl)oxane-4-carboxamide
CID 115438930
2-[[1-(aminomethyl)cyclobutanecarbonyl]amino]benzoic acid
CID 115448247
1-(aminomethyl)-N-(2-bromophenyl)cyclohexane-1-carboxamide
CID 113309812
2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]thiophene-3-carboxamide
CID 115435197
2-[(1-phenylcyclopentanecarbonyl)amino]benzamide
CID 28624302
2-[[1-(aminomethyl)cyclohexanecarbonyl]amino]thiophene-3-carboxamide
CID 115437776
2-[[1-(aminomethyl)cyclopentyl]amino]benzamide
CID 63887827
1-(aminomethyl)-N-(2-ethylsulfanylphenyl)cyclohexane-1-carboxamide
CID 115437472
2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]-5-hydroxybenzoic acid
CID 115435207
1-(aminomethyl)-N-(2,3-dimethylphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119670553
2-(3-aminopropanoylamino)benzamide
CID 22692052

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide?
The IUPAC name of 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide (CID 115434729) is 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide.
What is the SMILES notation for 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide?
The canonical SMILES for 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide is NCC1(C(=O)Nc2ccccc2C(N)=O)CCCC1.
What is the InChIKey of 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide?
The InChIKey is HSNMXYLSMFBGTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c15-9-14(7-3-4-8-14)13(19)17-11-6-2-1-5-10(11)12(16)18/h1-2,5-6H,3-4,7-9,15H2,(H2,16,18)(H,17,19).
What are the key properties of 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide?
2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide has a molecular weight of 261.32 g/mol, XLogP of 1.24, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide is sourced from PubChem (CID 115434729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).