2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide

C11H15N5O — CID 134714430

IUPAC2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide
SMILESCC(Cn1cccn1)C(=O)Nc1nccn1C
InChIInChI=1S/C11H15N5O/c1-9(8-16-6-3-4-13-16)10(17)14-11-12-5-7-15(11)2/h3-7,9H,8H2,1-2H3,(H,12,14,17)
InChIKeyWMQVNOPLMMDQAT-UHFFFAOYSA-N
MW233.28 g/mol
LogP0.89
Rot. Bonds4

About 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide

2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide (PubChem CID 134714430) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide
PubChem CID134714430
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide
SMILESCC(Cn1cccn1)C(=O)Nc1nccn1C
InChIInChI=1S/C11H15N5O/c1-9(8-16-6-3-4-13-16)10(17)14-11-12-5-7-15(11)2/h3-7,9H,8H2,1-2H3,(H,12,14,17)
InChIKeyWMQVNOPLMMDQAT-UHFFFAOYSA-N
XLogP0.89
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide?
The IUPAC name of 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide (CID 134714430) is 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide.
What is the SMILES notation for 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide?
The canonical SMILES for 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide is CC(Cn1cccn1)C(=O)Nc1nccn1C.
What is the InChIKey of 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide?
The InChIKey is WMQVNOPLMMDQAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-9(8-16-6-3-4-13-16)10(17)14-11-12-5-7-15(11)2/h3-7,9H,8H2,1-2H3,(H,12,14,17).
What are the key properties of 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide?
2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide has a molecular weight of 233.28 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methylimidazol-2-yl)-3-pyrazol-1-ylpropanamide is sourced from PubChem (CID 134714430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).