1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide

C9H13N3O — CID 130688568

IUPAC1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
SMILESCC1(C(=O)Nc2cn[nH]c2)CCC1
InChIInChI=1S/C9H13N3O/c1-9(3-2-4-9)8(13)12-7-5-10-11-6-7/h5-6H,2-4H2,1H3,(H,10,11)(H,12,13)
InChIKeyGKQBWUFQZICXBE-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.54
Rot. Bonds2

About 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide

1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide (PubChem CID 130688568) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
PubChem CID130688568
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
SMILESCC1(C(=O)Nc2cn[nH]c2)CCC1
InChIInChI=1S/C9H13N3O/c1-9(3-2-4-9)8(13)12-7-5-10-11-6-7/h5-6H,2-4H2,1H3,(H,10,11)(H,12,13)
InChIKeyGKQBWUFQZICXBE-UHFFFAOYSA-N
XLogP1.54
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

3-methyl-N-(1H-pyrazol-4-yl)piperidine-3-carboxamide;hydrochloride
CID 119944674
1-(aminomethyl)-N-(1H-pyrazol-4-yl)cyclopropane-1-carboxamide
CID 80588422
1-(1H-pyrazol-4-ylcarbamoyl)cycloheptane-1-carboxylic acid
CID 138033225
1-carbamothioyl-N-(1H-pyrazol-4-yl)cyclopropane-1-carboxamide
CID 80589522
3-propyl-N-(1H-pyrazol-4-yl)pyrrolidine-3-carboxamide
CID 63138545
3-fluoro-N-(1H-pyrazol-4-yl)pyrrolidine-3-carboxamide
CID 131020629
1-(aminomethyl)-3-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
CID 80588316
2-(1-hydroxycyclopentyl)-N-(1H-pyrazol-4-yl)acetamide
CID 111430521
1H-pyrazol-4-ylcarbamic acid
CID 66846920
1H-pyrazol-4-ylcarbamic acid
CID 66846919
N-(6-amino-3-pyridinyl)-1-methylcyclobutane-1-carboxamide;hydrochloride
CID 119515764
1-(1H-pyrazol-4-ylcarbamoylamino)cyclohexane-1-carboxylic acid
CID 61209991

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
The IUPAC name of 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide (CID 130688568) is 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide.
What is the SMILES notation for 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
The canonical SMILES for 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide is CC1(C(=O)Nc2cn[nH]c2)CCC1.
What is the InChIKey of 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
The InChIKey is GKQBWUFQZICXBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-9(3-2-4-9)8(13)12-7-5-10-11-6-7/h5-6H,2-4H2,1H3,(H,10,11)(H,12,13).
What are the key properties of 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide?
1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide has a molecular weight of 179.22 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide is sourced from PubChem (CID 130688568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).