2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide

C16H15N5O — CID 18717027

IUPAC2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
SMILESCc1ccccc1C(=O)Nc1cccc(-n2nnnc2C)c1
InChIInChI=1S/C16H15N5O/c1-11-6-3-4-9-15(11)16(22)17-13-7-5-8-14(10-13)21-12(2)18-19-20-21/h3-10H,1-2H3,(H,17,22)
InChIKeyGCZJBBFVKDFKMH-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.53
Rot. Bonds3

About 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide

2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide (PubChem CID 18717027) has the molecular formula C16H15N5O and a molecular weight of 293.33 g/mol. Its IUPAC name is 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
PubChem CID18717027
Molecular FormulaC16H15N5O
Molecular Weight293.33 g/mol
Exact Mass293.13
IUPAC Name2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
SMILESCc1ccccc1C(=O)Nc1cccc(-n2nnnc2C)c1
InChIInChI=1S/C16H15N5O/c1-11-6-3-4-9-15(11)16(22)17-13-7-5-8-14(10-13)21-12(2)18-19-20-21/h3-10H,1-2H3,(H,17,22)
InChIKeyGCZJBBFVKDFKMH-UHFFFAOYSA-N
XLogP2.53
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-5-methylsulfonyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide
CID 86983152
2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-4-phenylpyrimidine-5-carboxamide
CID 131889333
2-hydroxy-N-[3-(5-methyltetrazol-1-yl)phenyl]-2-phenylacetamide
CID 111432358
phenyl N-[3-(5-methyltetrazol-1-yl)phenyl]carbamate
CID 69112128
5-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-1,3-oxazole-4-carboxamide
CID 136579121
2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]-1,3-thiazole-5-carboxamide
CID 136579582
[3-(5-methyltetrazol-1-yl)phenyl]thiourea
CID 169356763
2-iodo-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-nitrobenzamide
CID 55882840
(2S)-2-(2-methylphenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]pyrrolidine-1-carboxamide
CID 94164440
N-[3-(5-methyltetrazol-1-yl)phenyl]quinoxaline-6-carboxamide
CID 131894718
5-ethyl-1-(4-methylphenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]pyrazole-4-carboxamide
CID 55676186
1-(2-fluorophenyl)-N-[3-(5-methyltetrazol-1-yl)phenyl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 112822525

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide?
The IUPAC name of 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide (CID 18717027) is 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide.
What is the SMILES notation for 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide?
The canonical SMILES for 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide is Cc1ccccc1C(=O)Nc1cccc(-n2nnnc2C)c1.
What is the InChIKey of 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide?
The InChIKey is GCZJBBFVKDFKMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O/c1-11-6-3-4-9-15(11)16(22)17-13-7-5-8-14(10-13)21-12(2)18-19-20-21/h3-10H,1-2H3,(H,17,22).
What are the key properties of 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide?
2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide has a molecular weight of 293.33 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(5-methyltetrazol-1-yl)phenyl]benzamide is sourced from PubChem (CID 18717027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).