N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide

C12H14N4O — CID 62688839

IUPACN-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide
SMILESCc1[nH]ncc1CNC(=O)Cc1cccnc1
InChIInChI=1S/C12H14N4O/c1-9-11(8-15-16-9)7-14-12(17)5-10-3-2-4-13-6-10/h2-4,6,8H,5,7H2,1H3,(H,14,17)(H,15,16)
InChIKeyYCEKXJHBMJGROE-UHFFFAOYSA-N
MW230.27 g/mol
LogP0.97
Rot. Bonds4

About N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide

N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide (PubChem CID 62688839) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide
PubChem CID62688839
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC NameN-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide
SMILESCc1[nH]ncc1CNC(=O)Cc1cccnc1
InChIInChI=1S/C12H14N4O/c1-9-11(8-15-16-9)7-14-12(17)5-10-3-2-4-13-6-10/h2-4,6,8H,5,7H2,1H3,(H,14,17)(H,15,16)
InChIKeyYCEKXJHBMJGROE-UHFFFAOYSA-N
XLogP0.97
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide 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

N-[(5-amino-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide
CID 79529546
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-thiophen-3-ylacetamide
CID 61021531
N-[(5-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide
CID 60767686
3-hydroxy-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridine-2-carboxamide
CID 61004398
5-methyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide
CID 61022740
N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridin-3-amine
CID 43663437
N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]-2-pyridin-3-ylacetamide
CID 154862718
2-[2-[(5-methyl-1H-pyrazol-4-yl)methylamino]-2-oxoethyl]sulfanylacetic acid
CID 104569662
5-chloro-N-[(5-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide
CID 61021663
3-(ethylamino)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 105069649
N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyridine-3-sulfonamide
CID 54896202
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrrole-2-carboxamide
CID 60768162

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide (CID 62688839) is N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide is Cc1[nH]ncc1CNC(=O)Cc1cccnc1.
What is the InChIKey of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide?
The InChIKey is YCEKXJHBMJGROE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-9-11(8-15-16-9)7-14-12(17)5-10-3-2-4-13-6-10/h2-4,6,8H,5,7H2,1H3,(H,14,17)(H,15,16).
What are the key properties of N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide?
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide has a molecular weight of 230.27 g/mol, XLogP of 0.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 62688839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).