N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide

C12H14N4O — CID 60508064

IUPACN-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide
SMILESCn1cc(NC(=O)CCc2ccncc2)cn1
InChIInChI=1S/C12H14N4O/c1-16-9-11(8-14-16)15-12(17)3-2-10-4-6-13-7-5-10/h4-9H,2-3H2,1H3,(H,15,17)
InChIKeyGJQUAKKJHQAGOG-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.39
Rot. Bonds4

About N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide

N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide (PubChem CID 60508064) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide
PubChem CID60508064
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide
SMILESCn1cc(NC(=O)CCc2ccncc2)cn1
InChIInChI=1S/C12H14N4O/c1-16-9-11(8-14-16)15-12(17)3-2-10-4-6-13-7-5-10/h4-9H,2-3H2,1H3,(H,15,17)
InChIKeyGJQUAKKJHQAGOG-UHFFFAOYSA-N
XLogP1.39
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide?
The IUPAC name of N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide (CID 60508064) is N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide is Cn1cc(NC(=O)CCc2ccncc2)cn1.
What is the InChIKey of N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide?
The InChIKey is GJQUAKKJHQAGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-16-9-11(8-14-16)15-12(17)3-2-10-4-6-13-7-5-10/h4-9H,2-3H2,1H3,(H,15,17).
What are the key properties of N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide?
N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide has a molecular weight of 230.27 g/mol, XLogP of 1.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-4-yl)-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 60508064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).