2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide

C7H12N4O2 — CID 103430270

IUPAC2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide
SMILESCn1ncnc1NC(=O)C(C)(C)O
InChIInChI=1S/C7H12N4O2/c1-7(2,13)5(12)10-6-8-4-9-11(6)3/h4,13H,1-3H3,(H,8,9,10,12)
InChIKeyJQMWYUHJAJKHGF-UHFFFAOYSA-N
MW184.20 g/mol
LogP-0.48
Rot. Bonds2

About 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide

2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide (PubChem CID 103430270) has the molecular formula C7H12N4O2 and a molecular weight of 184.20 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide.

Molecular Properties

Compound Name2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide
PubChem CID103430270
Molecular FormulaC7H12N4O2
Molecular Weight184.20 g/mol
Exact Mass184.10
IUPAC Name2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide
SMILESCn1ncnc1NC(=O)C(C)(C)O
InChIInChI=1S/C7H12N4O2/c1-7(2,13)5(12)10-6-8-4-9-11(6)3/h4,13H,1-3H3,(H,8,9,10,12)
InChIKeyJQMWYUHJAJKHGF-UHFFFAOYSA-N
XLogP-0.48
TPSA80.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide?
The IUPAC name of 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide (CID 103430270) is 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide.
What is the SMILES notation for 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide?
The canonical SMILES for 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide is Cn1ncnc1NC(=O)C(C)(C)O.
What is the InChIKey of 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide?
The InChIKey is JQMWYUHJAJKHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O2/c1-7(2,13)5(12)10-6-8-4-9-11(6)3/h4,13H,1-3H3,(H,8,9,10,12).
What are the key properties of 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide?
2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide has a molecular weight of 184.20 g/mol, XLogP of -0.48, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-N-(2-methyl-1,2,4-triazol-3-yl)propanamide is sourced from PubChem (CID 103430270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).