2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride

C13H17ClN6O — CID 119685776

IUPAC2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.NC1CCCC1C(=O)Nc1cccc(-n2cnnn2)c1
InChIInChI=1S/C13H16N6O.ClH/c14-12-6-2-5-11(12)13(20)16-9-3-1-4-10(7-9)19-8-15-17-18-19;/h1,3-4,7-8,11-12H,2,5-6,14H2,(H,16,20);1H
InChIKeyOEBJCGXXHMLUCR-UHFFFAOYSA-N
MW308.77 g/mol
LogP1.15
Rot. Bonds3

About 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride

2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119685776) has the molecular formula C13H17ClN6O and a molecular weight of 308.77 g/mol. Its IUPAC name is 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
PubChem CID119685776
Molecular FormulaC13H17ClN6O
Molecular Weight308.77 g/mol
Exact Mass308.12
IUPAC Name2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
SMILESCl.NC1CCCC1C(=O)Nc1cccc(-n2cnnn2)c1
InChIInChI=1S/C13H16N6O.ClH/c14-12-6-2-5-11(12)13(20)16-9-3-1-4-10(7-9)19-8-15-17-18-19;/h1,3-4,7-8,11-12H,2,5-6,14H2,(H,16,20);1H
InChIKeyOEBJCGXXHMLUCR-UHFFFAOYSA-N
XLogP1.15
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.77
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 64823717
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CID 43702817
2-amino-N-[3-(carbamoylamino)phenyl]cyclopentane-1-carboxamide
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1-cyclopentyl-3-[3-(tetrazol-1-yl)phenyl]urea
CID 47199011
2-amino-N-(3-imidazol-1-ylphenyl)cyclohexane-1-carboxamide
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2-amino-N-[3-(2-oxopyrrolidin-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119692820
4-methyl-N-[3-(tetrazol-1-yl)phenyl]piperidine-2-carboxamide
CID 114422985
4-methyl-N-[3-(tetrazol-1-yl)phenyl]thiadiazole-5-carboxamide
CID 146021769
2-amino-2-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 120784046
(2R)-2-amino-N-[3-(tetrazol-1-yl)phenyl]propanamide
CID 54991235
4-amino-N-[3-(tetrazol-1-yl)phenyl]benzamide
CID 43702822
(3S)-1-(oxan-4-yl)-N-[3-(tetrazol-1-yl)phenyl]piperidine-3-carboxamide
CID 25371663

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride (CID 119685776) is 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride is Cl.NC1CCCC1C(=O)Nc1cccc(-n2cnnn2)c1.
What is the InChIKey of 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is OEBJCGXXHMLUCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N6O.ClH/c14-12-6-2-5-11(12)13(20)16-9-3-1-4-10(7-9)19-8-15-17-18-19;/h1,3-4,7-8,11-12H,2,5-6,14H2,(H,16,20);1H.
What are the key properties of 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride?
2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 308.77 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[3-(tetrazol-1-yl)phenyl]cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119685776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).