3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide

C14H18N4O — CID 131916256

IUPAC3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
SMILESCC(Cc1cccnc1)NC(=O)CCc1cn[nH]c1
InChIInChI=1S/C14H18N4O/c1-11(7-12-3-2-6-15-8-12)18-14(19)5-4-13-9-16-17-10-13/h2-3,6,8-11H,4-5,7H2,1H3,(H,16,17)(H,18,19)
InChIKeyZFCRWCXRSZLZET-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.48
Rot. Bonds6

About 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide

3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide (PubChem CID 131916256) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide.

Molecular Properties

Compound Name3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
PubChem CID131916256
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
SMILESCC(Cc1cccnc1)NC(=O)CCc1cn[nH]c1
InChIInChI=1S/C14H18N4O/c1-11(7-12-3-2-6-15-8-12)18-14(19)5-4-13-9-16-17-10-13/h2-3,6,8-11H,4-5,7H2,1H3,(H,16,17)(H,18,19)
InChIKeyZFCRWCXRSZLZET-UHFFFAOYSA-N
XLogP1.48
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylethyl)propanamide
CID 122560537
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CID 86286437
N-[(2R)-1-(6-methyl-2-pyridinyl)propan-2-yl]-3-(1H-pyrazol-4-yl)propanamide
CID 124753193
4-chloro-N-(1-pyridin-3-ylpropan-2-yl)butanamide
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N-(1-imidazol-1-ylpropan-2-yl)-3-pyridin-3-ylpropanamide
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N-[1-(3-methylphenoxy)propan-2-yl]-3-pyridin-3-ylpropanamide
CID 86828425
N-[(2S)-3-methyl-1-oxobutan-2-yl]-3-pyridin-3-ylpropanamide
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N-(1-amino-4-methylpentan-2-yl)-3-pyridin-3-ylpropanamide
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CID 62691061
2-(3-chloro-4-hydroxyphenyl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]acetamide
CID 99973874
2-(1,3-benzodioxol-5-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]acetamide
CID 99926874

Frequently Asked Questions

What is the IUPAC name of 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
The IUPAC name of 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide (CID 131916256) is 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide.
What is the SMILES notation for 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
The canonical SMILES for 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide is CC(Cc1cccnc1)NC(=O)CCc1cn[nH]c1.
What is the InChIKey of 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
The InChIKey is ZFCRWCXRSZLZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-11(7-12-3-2-6-15-8-12)18-14(19)5-4-13-9-16-17-10-13/h2-3,6,8-11H,4-5,7H2,1H3,(H,16,17)(H,18,19).
What are the key properties of 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide has a molecular weight of 258.32 g/mol, XLogP of 1.48, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide is sourced from PubChem (CID 131916256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).