2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide

C10H11N5O2 — CID 62046673

IUPAC2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
SMILESCOCC(=O)Nc1cccnc1-n1cncn1
InChIInChI=1S/C10H11N5O2/c1-17-5-9(16)14-8-3-2-4-12-10(8)15-7-11-6-13-15/h2-4,6-7H,5H2,1H3,(H,14,16)
InChIKeyZKCHAWLAQYZTSZ-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.25
Rot. Bonds4

About 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide

2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide (PubChem CID 62046673) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
PubChem CID62046673
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Name2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
SMILESCOCC(=O)Nc1cccnc1-n1cncn1
InChIInChI=1S/C10H11N5O2/c1-17-5-9(16)14-8-3-2-4-12-10(8)15-7-11-6-13-15/h2-4,6-7H,5H2,1H3,(H,14,16)
InChIKeyZKCHAWLAQYZTSZ-UHFFFAOYSA-N
XLogP0.25
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
CID 47083831
4-amino-3-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]butanamide
CID 81087312
4-oxo-4-[[2-(1,2,4-triazol-1-yl)-3-pyridinyl]amino]but-2-enoic acid
CID 61167729
1-benzyl-1-methoxy-3-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]urea
CID 99707724
(2S)-2-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]butanamide;dihydrochloride
CID 119859600
2-[benzenesulfonyl(methyl)amino]-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
CID 47083800
4-amino-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]benzamide
CID 51983091
1-(3-butoxypropyl)-3-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]urea
CID 60616709
N-[(4-ethylphenyl)methyl]-2-(1,2,4-triazol-1-yl)pyridin-3-amine
CID 61166356
6-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]pyridazine-3-carboxamide
CID 61217247
2-chloro-5-methylsulfanyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]benzamide
CID 47084179
2-methyl-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]pyrrolidine-3-carboxamide
CID 79388465

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide (CID 62046673) is 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide is COCC(=O)Nc1cccnc1-n1cncn1.
What is the InChIKey of 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The InChIKey is ZKCHAWLAQYZTSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-17-5-9(16)14-8-3-2-4-12-10(8)15-7-11-6-13-15/h2-4,6-7H,5H2,1H3,(H,14,16).
What are the key properties of 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide has a molecular weight of 233.23 g/mol, XLogP of 0.25, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 62046673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).