N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide

C9H10N6O — CID 110499525

IUPACN-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide
SMILESCc1cccnc1NC(=O)Cc1nn[nH]n1
InChIInChI=1S/C9H10N6O/c1-6-3-2-4-10-9(6)11-8(16)5-7-12-14-15-13-7/h2-4H,5H2,1H3,(H,10,11,16)(H,12,13,14,15)
InChIKeySXHXGDBBFVKWJK-UHFFFAOYSA-N
MW218.22 g/mol
LogP0.08
Rot. Bonds3

About N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide

N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide (PubChem CID 110499525) has the molecular formula C9H10N6O and a molecular weight of 218.22 g/mol. Its IUPAC name is N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide
PubChem CID110499525
Molecular FormulaC9H10N6O
Molecular Weight218.22 g/mol
Exact Mass218.09
IUPAC NameN-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide
SMILESCc1cccnc1NC(=O)Cc1nn[nH]n1
InChIInChI=1S/C9H10N6O/c1-6-3-2-4-10-9(6)11-8(16)5-7-12-14-15-13-7/h2-4H,5H2,1H3,(H,10,11,16)(H,12,13,14,15)
InChIKeySXHXGDBBFVKWJK-UHFFFAOYSA-N
XLogP0.08
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.22
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,3-dimethylphenyl)-2-(2H-tetrazol-5-yl)acetamide
CID 110499379
N-(2-chloro-3-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide
CID 110499519
2-(2-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
CID 60615989
4-[(3-methyl-2-pyridinyl)amino]-4-oxobutanoic acid
CID 810222
N-(2-hydroxyphenyl)-2-(2H-tetrazol-5-yl)acetamide
CID 110499452
2-(1,2-benzoxazol-3-yl)-N-(3-methyl-2-pyridinyl)acetamide
CID 22519739
2-anilino-N-(3-methyl-2-pyridinyl)acetamide
CID 60860277
N-(3-methyl-2-pyridinyl)-2-propylsulfanylacetamide
CID 52671364
5-[(3-methyl-2-pyridinyl)amino]-5-oxopentanoate
CID 5059391
5-bromo-N-(3-methyl-2-pyridinyl)pentanamide
CID 107907296
N-(3-methoxyisoquinolin-1-yl)-2-(2H-tetrazol-5-yl)acetamide
CID 166387793
2-(5,7-dimethyl-1,2-benzoxazol-3-yl)-N-(3-methyl-2-pyridinyl)acetamide
CID 108806118

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide?
The IUPAC name of N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide (CID 110499525) is N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide.
What is the SMILES notation for N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide?
The canonical SMILES for N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide is Cc1cccnc1NC(=O)Cc1nn[nH]n1.
What is the InChIKey of N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide?
The InChIKey is SXHXGDBBFVKWJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6O/c1-6-3-2-4-10-9(6)11-8(16)5-7-12-14-15-13-7/h2-4H,5H2,1H3,(H,10,11,16)(H,12,13,14,15).
What are the key properties of N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide?
N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide has a molecular weight of 218.22 g/mol, XLogP of 0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-pyridinyl)-2-(2H-tetrazol-5-yl)acetamide is sourced from PubChem (CID 110499525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).