(2S)-2-pyrazol-1-ylpropanamide

C6H9N3O — CID 42576360

IUPAC(2S)-2-pyrazol-1-ylpropanamide
SMILESC[C@@H](C(N)=O)n1cccn1
InChIInChI=1S/C6H9N3O/c1-5(6(7)10)9-4-2-3-8-9/h2-5H,1H3,(H2,7,10)/t5-/m0/s1
InChIKeyCVZRDDTXGDTKOJ-YFKPBYRVSA-N
MW139.16 g/mol
LogP-0.07
Rot. Bonds2

About (2S)-2-pyrazol-1-ylpropanamide

(2S)-2-pyrazol-1-ylpropanamide (PubChem CID 42576360) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is (2S)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound Name(2S)-2-pyrazol-1-ylpropanamide
PubChem CID42576360
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name(2S)-2-pyrazol-1-ylpropanamide
SMILESC[C@@H](C(N)=O)n1cccn1
InChIInChI=1S/C6H9N3O/c1-5(6(7)10)9-4-2-3-8-9/h2-5H,1H3,(H2,7,10)/t5-/m0/s1
InChIKeyCVZRDDTXGDTKOJ-YFKPBYRVSA-N
XLogP-0.07
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-pyrazol-1-ylpropanamide
CID 25248322
N-(1-aminopropan-2-yl)-2-pyrazol-1-ylpropanamide
CID 63732994
N-(2-amino-2-methylpropyl)-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 119626027
1-(4-acetylpiperazin-1-yl)-2-pyrazol-1-ylpropan-1-one
CID 51076824
4-hydroxy-3-pyrazol-1-ylpentanamide
CID 56974979
N-(1-amino-2-methylpropan-2-yl)-2-pyrazol-1-ylpropanamide;dihydrochloride
CID 119521574
3-methyl-2-(2-pyrazol-1-ylpropanoylamino)butanoic acid
CID 43211034
N-phenyl-2-pyrazol-1-ylpropanamide
CID 42949018
N-(4-hydroxybutan-2-yl)-2-pyrazol-1-ylpropanamide
CID 81047310
2-methyl-3-(2-pyrazol-1-ylpropanoylamino)propanoic acid
CID 62676010
1-morpholin-4-yl-2-pyrazol-1-ylpropan-1-one
CID 51076822
4-pyrazol-1-ylpentan-2-one
CID 64696906

Frequently Asked Questions

What is the IUPAC name of (2S)-2-pyrazol-1-ylpropanamide?
The IUPAC name of (2S)-2-pyrazol-1-ylpropanamide (CID 42576360) is (2S)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for (2S)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for (2S)-2-pyrazol-1-ylpropanamide is C[C@@H](C(N)=O)n1cccn1.
What is the InChIKey of (2S)-2-pyrazol-1-ylpropanamide?
The InChIKey is CVZRDDTXGDTKOJ-YFKPBYRVSA-N. The full InChI is InChI=1S/C6H9N3O/c1-5(6(7)10)9-4-2-3-8-9/h2-5H,1H3,(H2,7,10)/t5-/m0/s1.
What are the key properties of (2S)-2-pyrazol-1-ylpropanamide?
(2S)-2-pyrazol-1-ylpropanamide has a molecular weight of 139.16 g/mol, XLogP of -0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 42576360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).