2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide

C13H17N5O2 — CID 138042361

IUPAC2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide
SMILESCOC(C)(C)C(=O)Nc1n[nH]c(-c2cccc(C)n2)n1
InChIInChI=1S/C13H17N5O2/c1-8-6-5-7-9(14-8)10-15-12(18-17-10)16-11(19)13(2,3)20-4/h5-7H,1-4H3,(H2,15,16,17,18,19)
InChIKeyWCNQPMKFYHGPPG-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.54
Rot. Bonds4

About 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide

2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide (PubChem CID 138042361) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide.

Molecular Properties

Compound Name2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide
PubChem CID138042361
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide
SMILESCOC(C)(C)C(=O)Nc1n[nH]c(-c2cccc(C)n2)n1
InChIInChI=1S/C13H17N5O2/c1-8-6-5-7-9(14-8)10-15-12(18-17-10)16-11(19)13(2,3)20-4/h5-7H,1-4H3,(H2,15,16,17,18,19)
InChIKeyWCNQPMKFYHGPPG-UHFFFAOYSA-N
XLogP1.54
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]-3-(phenylcarbamoylamino)benzamide
CID 166213330
N-[5-(4-ethoxyphenyl)-1H-1,2,4-triazol-3-yl]-2,2-dimethylpropanamide
CID 58561988
N-[3-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]amino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 49196261
N-[5-[4-(3-acetamido-1H-1,2,4-triazol-5-yl)phenyl]-1H-1,2,4-triazol-3-yl]acetamide
CID 44615693
2-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]phenol
CID 135429519
N-[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]-2-methyl-2-(2-methylpropylsulfonyl)propanamide
CID 54772185
4-methyl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide
CID 86992065
2-methoxy-2-methyl-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 103029054
2-(cyclopropylmethylsulfanyl)-N-[5-(3-hydroxyphenyl)-1H-1,2,4-triazol-3-yl]-2-methylpropanamide
CID 90935334
2-(4-methylphenoxy)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide
CID 86992055
2-(4-chlorophenoxy)-2-methyl-N-(6-methyl-2-pyridinyl)propanamide
CID 800401
N-[5-bromo-4-(6-methyl-2-pyridinyl)-1H-imidazol-2-yl]acetamide
CID 135223176

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide?
The IUPAC name of 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide (CID 138042361) is 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide.
What is the SMILES notation for 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide?
The canonical SMILES for 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide is COC(C)(C)C(=O)Nc1n[nH]c(-c2cccc(C)n2)n1.
What is the InChIKey of 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide?
The InChIKey is WCNQPMKFYHGPPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-8-6-5-7-9(14-8)10-15-12(18-17-10)16-11(19)13(2,3)20-4/h5-7H,1-4H3,(H2,15,16,17,18,19).
What are the key properties of 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide?
2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide has a molecular weight of 275.31 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-methyl-N-[5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-yl]propanamide is sourced from PubChem (CID 138042361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).