2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide

C10H12N6O — CID 43713144

IUPAC2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide
SMILESCc1cc(NC(=O)CN)ccc1-n1cnnn1
InChIInChI=1S/C10H12N6O/c1-7-4-8(13-10(17)5-11)2-3-9(7)16-6-12-14-15-16/h2-4,6H,5,11H2,1H3,(H,13,17)
InChIKeyAWUNRYWYRLHUME-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.13
Rot. Bonds3

About 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide

2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 43713144) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID43713144
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide
SMILESCc1cc(NC(=O)CN)ccc1-n1cnnn1
InChIInChI=1S/C10H12N6O/c1-7-4-8(13-10(17)5-11)2-3-9(7)16-6-12-14-15-16/h2-4,6H,5,11H2,1H3,(H,13,17)
InChIKeyAWUNRYWYRLHUME-UHFFFAOYSA-N
XLogP-0.13
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,2-dimethyl-N-[3-methyl-4-(tetrazol-1-yl)phenyl]propanamide
CID 36723262
2,2,2-trifluoroethyl N-[3-methyl-4-(tetrazol-1-yl)phenyl]carbamate
CID 65173261
3-(4-fluorophenyl)-N-[3-methyl-4-(tetrazol-1-yl)phenyl]propanamide
CID 134044042
N-[3-methyl-4-(tetrazol-1-yl)phenyl]but-2-enamide
CID 112725296
N-ethyl-3-methyl-4-(tetrazol-1-yl)aniline
CID 43732922
2-methyl-2-(methylamino)-N-[3-methyl-4-(tetrazol-1-yl)phenyl]propanamide
CID 62847424
(E)-4-[3-methyl-4-(tetrazol-1-yl)anilino]-4-oxobut-2-enoic acid
CID 60940580
4-amino-N-[4-methyl-3-(tetrazol-1-yl)phenyl]butanamide;hydrochloride
CID 119287688
3-(4-fluorophenyl)sulfanyl-N-[3-methyl-4-(tetrazol-1-yl)phenyl]propanamide
CID 36722357
N-(2-methylbutan-2-yl)-2-[3-methyl-4-(tetrazol-1-yl)anilino]acetamide
CID 32974148
2,4,5-trimethyl-N-[3-methyl-4-(tetrazol-1-yl)phenyl]furan-3-carboxamide
CID 36723061
N-[3-methyl-4-(tetrazol-1-yl)phenyl]furan-2-carboxamide
CID 858850

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide (CID 43713144) is 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide is Cc1cc(NC(=O)CN)ccc1-n1cnnn1.
What is the InChIKey of 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is AWUNRYWYRLHUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c1-7-4-8(13-10(17)5-11)2-3-9(7)16-6-12-14-15-16/h2-4,6H,5,11H2,1H3,(H,13,17).
What are the key properties of 2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide?
2-amino-N-[3-methyl-4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 232.25 g/mol, XLogP of -0.13, 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-methyl-4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 43713144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).