3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide

C10H13N5O — CID 61004651

IUPAC3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide
SMILESO=C(CCn1cccn1)NCc1cn[nH]c1
InChIInChI=1S/C10H13N5O/c16-10(2-5-15-4-1-3-14-15)11-6-9-7-12-13-8-9/h1,3-4,7-8H,2,5-6H2,(H,11,16)(H,12,13)
InChIKeyPXMAXFHSJPPUOO-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.31
Rot. Bonds5

About 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide

3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide (PubChem CID 61004651) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide.

Molecular Properties

Compound Name3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide
PubChem CID61004651
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide
SMILESO=C(CCn1cccn1)NCc1cn[nH]c1
InChIInChI=1S/C10H13N5O/c16-10(2-5-15-4-1-3-14-15)11-6-9-7-12-13-8-9/h1,3-4,7-8H,2,5-6H2,(H,11,16)(H,12,13)
InChIKeyPXMAXFHSJPPUOO-UHFFFAOYSA-N
XLogP0.31
TPSA75.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide 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-[[4-(aminomethyl)phenyl]methyl]-3-pyrazol-1-ylpropanamide
CID 81089925
3-pyrazol-1-yl-N-(1H-1,2,4-triazol-5-ylmethyl)propanamide
CID 60982939
4-phenyl-N-(1H-pyrazol-4-ylmethyl)butanamide
CID 60769926
N-(1H-pyrazol-4-ylmethyl)-3-pyridin-2-ylpropanamide
CID 78981080
3-(4-methylpyrazol-1-yl)-N-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide
CID 87042762
4-amino-4-phenyl-N-(1H-pyrazol-4-ylmethyl)butanamide
CID 55205488
4-[(4-pyrazol-1-ylbutanoylamino)methyl]benzoic acid
CID 119353286
2,2-dimethyl-N-(1H-pyrazol-4-ylmethyl)butanamide
CID 62677107
N-(2,2-difluoro-3-hydroxypropyl)-3-pyrazol-1-ylpropanamide
CID 104858205
N-[4-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-4-carboxamide
CID 60934045
2-methyl-N-(1H-pyrazol-4-ylmethyl)propanamide
CID 60735981
N-[2-(2,6-dimethylphenoxy)ethyl]-3-pyrazol-1-ylpropanamide
CID 47036492

Frequently Asked Questions

What is the IUPAC name of 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide?
The IUPAC name of 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide (CID 61004651) is 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide.
What is the SMILES notation for 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide?
The canonical SMILES for 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide is O=C(CCn1cccn1)NCc1cn[nH]c1.
What is the InChIKey of 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide?
The InChIKey is PXMAXFHSJPPUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c16-10(2-5-15-4-1-3-14-15)11-6-9-7-12-13-8-9/h1,3-4,7-8H,2,5-6H2,(H,11,16)(H,12,13).
What are the key properties of 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide?
3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide has a molecular weight of 219.25 g/mol, XLogP of 0.31, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazol-1-yl-N-(1H-pyrazol-4-ylmethyl)propanamide is sourced from PubChem (CID 61004651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).