N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide

C10H15N3O — CID 5330972

IUPACN-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide
SMILESCCCC(=O)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C10H15N3O/c1-2-3-10(14)11-9-6-8(12-13-9)7-4-5-7/h6-7H,2-5H2,1H3,(H2,11,12,13,14)
InChIKeyKPQLRNNPRYBTLP-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.03
Rot. Bonds4

About N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide

N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide (PubChem CID 5330972) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide.

Molecular Properties

Compound NameN-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide
PubChem CID5330972
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide
SMILESCCCC(=O)Nc1cc(C2CC2)[nH]n1
InChIInChI=1S/C10H15N3O/c1-2-3-10(14)11-9-6-8(12-13-9)7-4-5-7/h6-7H,2-5H2,1H3,(H2,11,12,13,14)
InChIKeyKPQLRNNPRYBTLP-UHFFFAOYSA-N
XLogP2.03
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide?
The IUPAC name of N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide (CID 5330972) is N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide.
What is the SMILES notation for N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide?
The canonical SMILES for N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide is CCCC(=O)Nc1cc(C2CC2)[nH]n1.
What is the InChIKey of N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide?
The InChIKey is KPQLRNNPRYBTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-3-10(14)11-9-6-8(12-13-9)7-4-5-7/h6-7H,2-5H2,1H3,(H2,11,12,13,14).
What are the key properties of N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide?
N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide has a molecular weight of 193.25 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-cyclopropyl-1H-pyrazol-3-yl)butanamide is sourced from PubChem (CID 5330972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).