2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide

C11H17N3O — CID 79506566

IUPAC2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)C1CC1
InChIInChI=1S/C11H17N3O/c1-6(9-4-5-9)11(15)12-10-7(2)13-14-8(10)3/h6,9H,4-5H2,1-3H3,(H,12,15)(H,13,14)
InChIKeyJIHZDMLJXDBQCV-UHFFFAOYSA-N
MW207.28 g/mol
LogP2.01
Rot. Bonds3

About 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide

2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide (PubChem CID 79506566) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
PubChem CID79506566
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
SMILESCc1n[nH]c(C)c1NC(=O)C(C)C1CC1
InChIInChI=1S/C11H17N3O/c1-6(9-4-5-9)11(15)12-10-7(2)13-14-8(10)3/h6,9H,4-5H2,1-3H3,(H,12,15)(H,13,14)
InChIKeyJIHZDMLJXDBQCV-UHFFFAOYSA-N
XLogP2.01
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
The IUPAC name of 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide (CID 79506566) is 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide.
What is the SMILES notation for 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
The canonical SMILES for 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide is Cc1n[nH]c(C)c1NC(=O)C(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
The InChIKey is JIHZDMLJXDBQCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-6(9-4-5-9)11(15)12-10-7(2)13-14-8(10)3/h6,9H,4-5H2,1-3H3,(H,12,15)(H,13,14).
What are the key properties of 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide?
2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide has a molecular weight of 207.28 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide is sourced from PubChem (CID 79506566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).