1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide

C21H24N6O — CID 119312718

IUPAC1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(CCn3nnc(-c4ccccc4)n3)cc2)CCCC1
InChIInChI=1S/C21H24N6O/c22-21(13-4-5-14-21)20(28)23-18-10-8-16(9-11-18)12-15-27-25-19(24-26-27)17-6-2-1-3-7-17/h1-3,6-11H,4-5,12-15,22H2,(H,23,28)
InChIKeyZHUKCTNAJJATSM-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.79
Rot. Bonds6

About 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide

1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide (PubChem CID 119312718) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide
PubChem CID119312718
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide
SMILESNC1(C(=O)Nc2ccc(CCn3nnc(-c4ccccc4)n3)cc2)CCCC1
InChIInChI=1S/C21H24N6O/c22-21(13-4-5-14-21)20(28)23-18-10-8-16(9-11-18)12-15-27-25-19(24-26-27)17-6-2-1-3-7-17/h1-3,6-11H,4-5,12-15,22H2,(H,23,28)
InChIKeyZHUKCTNAJJATSM-UHFFFAOYSA-N
XLogP2.79
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclohexane-1-carboxamide
CID 119312724
3-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]butanamide;hydrochloride
CID 119764922
2-methyl-3-(methylamino)-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]propanamide
CID 119764919
N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]piperidine-2-carboxamide
CID 119312708
2-amino-3-methoxy-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]propanamide;hydrochloride
CID 120988311
N-(ethylcarbamoyl)-2-[4-[2-(5-phenyltetrazol-2-yl)ethyl]anilino]acetamide
CID 60614990
N-[3-[3-aminopropyl(methyl)amino]propyl]-N'-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]oxamide
CID 167832296
2-(5-phenyltetrazol-2-yl)-N-(4-propylphenyl)acetamide
CID 24564895
1-amino-N-(4-propylphenyl)cyclopentane-1-carboxamide
CID 54925144
1-amino-N-[4-(3-phenylpropyl)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119769369
1-amino-N-[4-(2H-tetrazol-5-yl)phenyl]cyclohexane-1-carboxamide
CID 119312969
1-amino-N-(4-ethylphenyl)cyclopentane-1-carboxamide
CID 60867224

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide (CID 119312718) is 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide is NC1(C(=O)Nc2ccc(CCn3nnc(-c4ccccc4)n3)cc2)CCCC1.
What is the InChIKey of 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide?
The InChIKey is ZHUKCTNAJJATSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c22-21(13-4-5-14-21)20(28)23-18-10-8-16(9-11-18)12-15-27-25-19(24-26-27)17-6-2-1-3-7-17/h1-3,6-11H,4-5,12-15,22H2,(H,23,28).
What are the key properties of 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide?
1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[4-[2-(5-phenyltetrazol-2-yl)ethyl]phenyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 119312718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).