N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide

C11H17N3O — CID 33381566

IUPACN-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide
SMILESCc1c(C(=O)NCC2CCC2)cnn1C
InChIInChI=1S/C11H17N3O/c1-8-10(7-13-14(8)2)11(15)12-6-9-4-3-5-9/h7,9H,3-6H2,1-2H3,(H,12,15)
InChIKeyWFWUJGIABNGBBR-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.26
Rot. Bonds3

About N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide

N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide (PubChem CID 33381566) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide
PubChem CID33381566
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC NameN-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide
SMILESCc1c(C(=O)NCC2CCC2)cnn1C
InChIInChI=1S/C11H17N3O/c1-8-10(7-13-14(8)2)11(15)12-6-9-4-3-5-9/h7,9H,3-6H2,1-2H3,(H,12,15)
InChIKeyWFWUJGIABNGBBR-UHFFFAOYSA-N
XLogP1.26
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide 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 N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide (CID 33381566) is N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide is Cc1c(C(=O)NCC2CCC2)cnn1C.
What is the InChIKey of N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide?
The InChIKey is WFWUJGIABNGBBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-10(7-13-14(8)2)11(15)12-6-9-4-3-5-9/h7,9H,3-6H2,1-2H3,(H,12,15).
What are the key properties of N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide?
N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide has a molecular weight of 207.28 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-1,5-dimethylpyrazole-4-carboxamide is sourced from PubChem (CID 33381566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).