N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide

C19H18N6O2 — CID 27995227

IUPACN-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide
SMILESO=C(Cn1nnc(-c2ccccc2)n1)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C19H18N6O2/c26-17(12-25-23-18(22-24-25)13-6-2-1-3-7-13)21-16-9-5-4-8-15(16)19(27)20-14-10-11-14/h1-9,14H,10-12H2,(H,20,27)(H,21,26)
InChIKeyWLFQQSWWIHPAJX-UHFFFAOYSA-N
MW362.39 g/mol
LogP1.87
Rot. Bonds6

About N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide

N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide (PubChem CID 27995227) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide
PubChem CID27995227
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC NameN-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide
SMILESO=C(Cn1nnc(-c2ccccc2)n1)Nc1ccccc1C(=O)NC1CC1
InChIInChI=1S/C19H18N6O2/c26-17(12-25-23-18(22-24-25)13-6-2-1-3-7-13)21-16-9-5-4-8-15(16)19(27)20-14-10-11-14/h1-9,14H,10-12H2,(H,20,27)(H,21,26)
InChIKeyWLFQQSWWIHPAJX-UHFFFAOYSA-N
XLogP1.87
TPSA101.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[2-[5-(4-methylphenyl)tetrazol-2-yl]acetyl]amino]-N-(1-phenylethyl)benzamide
CID 24594294
2-(5-phenyltetrazol-2-yl)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 16508183
2-[[2-[5-(4-bromophenyl)tetrazol-2-yl]acetyl]amino]-N-propan-2-ylbenzamide
CID 36982859
N-(2-phenylphenyl)-2-(5-pyridin-4-yltetrazol-2-yl)acetamide
CID 3738322
2-(5-phenyltetrazol-2-yl)-N-(2,4,5-trichlorophenyl)acetamide
CID 2491710
1-[2-[2-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide
CID 8530807
N-(dicyclopropylmethyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 29466684
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 24564897
N-cyclopropyl-2-[(2-morpholin-4-ylacetyl)amino]benzamide
CID 2697520
N-(3-bromo-4-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 7634201
N-(2-methylpiperidin-4-yl)-2-(5-phenyltetrazol-2-yl)acetamide;hydrochloride
CID 120602010
2-(5-phenyltetrazol-2-yl)-N-(2-piperidin-1-yl-3-pyridinyl)acetamide
CID 55979042

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide?
The IUPAC name of N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide (CID 27995227) is N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide.
What is the SMILES notation for N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide?
The canonical SMILES for N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide is O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccccc1C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide?
The InChIKey is WLFQQSWWIHPAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c26-17(12-25-23-18(22-24-25)13-6-2-1-3-7-13)21-16-9-5-4-8-15(16)19(27)20-14-10-11-14/h1-9,14H,10-12H2,(H,20,27)(H,21,26).
What are the key properties of N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide?
N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide has a molecular weight of 362.39 g/mol, XLogP of 1.87, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]benzamide is sourced from PubChem (CID 27995227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).