2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide

C13H23N5O2 — CID 115633314

IUPAC2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide
SMILESCCCc1cc(NC(=O)C(NC(N)=O)C(C)CC)n[nH]1
InChIInChI=1S/C13H23N5O2/c1-4-6-9-7-10(18-17-9)15-12(19)11(8(3)5-2)16-13(14)20/h7-8,11H,4-6H2,1-3H3,(H3,14,16,20)(H2,15,17,18,19)
InChIKeyZDJOHZSCLZKSMO-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.38
Rot. Bonds7

About 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide

2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide (PubChem CID 115633314) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide.

Molecular Properties

Compound Name2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide
PubChem CID115633314
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide
SMILESCCCc1cc(NC(=O)C(NC(N)=O)C(C)CC)n[nH]1
InChIInChI=1S/C13H23N5O2/c1-4-6-9-7-10(18-17-9)15-12(19)11(8(3)5-2)16-13(14)20/h7-8,11H,4-6H2,1-3H3,(H3,14,16,20)(H2,15,17,18,19)
InChIKeyZDJOHZSCLZKSMO-UHFFFAOYSA-N
XLogP1.38
TPSA112.90 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.38
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Analyze 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide?
The IUPAC name of 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide (CID 115633314) is 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide.
What is the SMILES notation for 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide?
The canonical SMILES for 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide is CCCc1cc(NC(=O)C(NC(N)=O)C(C)CC)n[nH]1.
What is the InChIKey of 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide?
The InChIKey is ZDJOHZSCLZKSMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-4-6-9-7-10(18-17-9)15-12(19)11(8(3)5-2)16-13(14)20/h7-8,11H,4-6H2,1-3H3,(H3,14,16,20)(H2,15,17,18,19).
What are the key properties of 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide?
2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide has a molecular weight of 281.36 g/mol, XLogP of 1.38, 7 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-3-methyl-N-(5-propyl-1H-pyrazol-3-yl)pentanamide is sourced from PubChem (CID 115633314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).