N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide

C14H18N6O — CID 119602087

IUPACN-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide
SMILESNCC1CCCC1NC(=O)c1ccccc1-n1cnnn1
InChIInChI=1S/C14H18N6O/c15-8-10-4-3-6-12(10)17-14(21)11-5-1-2-7-13(11)20-9-16-18-19-20/h1-2,5,7,9-10,12H,3-4,6,8,15H2,(H,17,21)
InChIKeyGPQZDQYOQQBZAM-UHFFFAOYSA-N
MW286.34 g/mol
LogP0.52
Rot. Bonds4

About N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide

N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide (PubChem CID 119602087) has the molecular formula C14H18N6O and a molecular weight of 286.34 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide
PubChem CID119602087
Molecular FormulaC14H18N6O
Molecular Weight286.34 g/mol
Exact Mass286.15
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide
SMILESNCC1CCCC1NC(=O)c1ccccc1-n1cnnn1
InChIInChI=1S/C14H18N6O/c15-8-10-4-3-6-12(10)17-14(21)11-5-1-2-7-13(11)20-9-16-18-19-20/h1-2,5,7,9-10,12H,3-4,6,8,15H2,(H,17,21)
InChIKeyGPQZDQYOQQBZAM-UHFFFAOYSA-N
XLogP0.52
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methylcyclohexyl)-2-(tetrazol-1-yl)benzamide
CID 78789651
N-[2-(aminomethyl)cyclopentyl]-4-(tetrazol-1-yl)benzamide;hydrochloride
CID 119603577
N-[2-(aminomethyl)cyclopentyl]-2-benzoylbenzamide;hydrochloride
CID 119600470
N-[(1S,2R)-2-(aminomethyl)cyclopentyl]benzamide
CID 94903786
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(tetrazol-1-yl)benzamide
CID 119456565
N-(1,2,3,4-tetrahydronaphthalen-1-yl)-2-(tetrazol-1-yl)benzamide
CID 4879166
N-[2-(aminomethyl)cyclopentyl]-2-(2-amino-2-oxoethyl)sulfanylbenzamide
CID 119600661
N-[2-(aminomethyl)cyclopentyl]-2-methylsulfonylbenzamide
CID 119601875
N-[(1-hydroxycyclobutyl)methyl]-2-(tetrazol-1-yl)benzamide
CID 111445767
N-chloro-2-(tetrazol-1-yl)benzamide
CID 91422333
N-[2-(aminomethyl)cyclohexyl]-2-methylbenzamide;hydrochloride
CID 119609179
N-[2-(aminomethyl)cyclopentyl]-1,3-diphenylpyrazole-4-carboxamide;hydrochloride
CID 119601120

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide (CID 119602087) is N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide is NCC1CCCC1NC(=O)c1ccccc1-n1cnnn1.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide?
The InChIKey is GPQZDQYOQQBZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O/c15-8-10-4-3-6-12(10)17-14(21)11-5-1-2-7-13(11)20-9-16-18-19-20/h1-2,5,7,9-10,12H,3-4,6,8,15H2,(H,17,21).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide?
N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide has a molecular weight of 286.34 g/mol, XLogP of 0.52, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-2-(tetrazol-1-yl)benzamide is sourced from PubChem (CID 119602087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).