2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide

C9H13N3O — CID 79506371

IUPAC2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide
SMILESCC(C(=O)Nc1cn[nH]c1)C1CC1
InChIInChI=1S/C9H13N3O/c1-6(7-2-3-7)9(13)12-8-4-10-11-5-8/h4-7H,2-3H2,1H3,(H,10,11)(H,12,13)
InChIKeyMBWQQWAOACXPCB-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.39
Rot. Bonds3

About 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide

2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide (PubChem CID 79506371) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide
PubChem CID79506371
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide
SMILESCC(C(=O)Nc1cn[nH]c1)C1CC1
InChIInChI=1S/C9H13N3O/c1-6(7-2-3-7)9(13)12-8-4-10-11-5-8/h4-7H,2-3H2,1H3,(H,10,11)(H,12,13)
InChIKeyMBWQQWAOACXPCB-UHFFFAOYSA-N
XLogP1.39
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(1H-pyrazol-4-yl)propanamide
CID 43540259
2-amino-3-methyl-N-(1H-pyrazol-4-yl)butanamide
CID 43540260
(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide
CID 83618000
N-(4-amino-1H-pyrazol-5-yl)-2-cyclopropylpropanamide
CID 83147507
2-oxo-2-(1H-pyrazol-4-ylamino)acetic acid
CID 43540349
1H-pyrazol-4-ylcarbamic acid
CID 66846920
1H-pyrazol-4-ylcarbamic acid
CID 66846919
2-cyclopropyl-N-[4-(1-hydroxyethyl)phenyl]propanamide
CID 83148427
(2R)-N-(4-fluorophenyl)-2-(4-methylcyclohexyl)propanamide
CID 138502747
2-hydroxy-N-(1H-pyrazol-4-yl)acetamide
CID 83815139
N-(4-carbamothioyl-1H-pyrazol-5-yl)-2-cyclopropylpropanamide
CID 83155299
3-(methylamino)-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
CID 164651415

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide?
The IUPAC name of 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide (CID 79506371) is 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide?
The canonical SMILES for 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide is CC(C(=O)Nc1cn[nH]c1)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide?
The InChIKey is MBWQQWAOACXPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-6(7-2-3-7)9(13)12-8-4-10-11-5-8/h4-7H,2-3H2,1H3,(H,10,11)(H,12,13).
What are the key properties of 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide?
2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide has a molecular weight of 179.22 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 79506371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).