1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide

C11H18N4O — CID 79637821

IUPAC1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide
SMILESCc1cnn(C2CCCC(N)(C(N)=O)C2)c1
InChIInChI=1S/C11H18N4O/c1-8-6-14-15(7-8)9-3-2-4-11(13,5-9)10(12)16/h6-7,9H,2-5,13H2,1H3,(H2,12,16)
InChIKeyUUXLYHXJYZRJQK-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.49
Rot. Bonds2

About 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide

1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide (PubChem CID 79637821) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide
PubChem CID79637821
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide
SMILESCc1cnn(C2CCCC(N)(C(N)=O)C2)c1
InChIInChI=1S/C11H18N4O/c1-8-6-14-15(7-8)9-3-2-4-11(13,5-9)10(12)16/h6-7,9H,2-5,13H2,1H3,(H2,12,16)
InChIKeyUUXLYHXJYZRJQK-UHFFFAOYSA-N
XLogP0.49
TPSA86.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-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

1-amino-3-(4-iodopyrazol-1-yl)cyclohexane-1-carboxamide
CID 79637306
methyl 1-amino-3-(4-methylpyrazol-1-yl)cyclopentane-1-carboxylate
CID 79651037
1-cyclobutyl-4-methylpyrazole
CID 59225391
1-cyclobutyl-4-methylpyrazole;ethane;methanol
CID 162747933
1-amino-3-indazol-1-ylcyclohexane-1-carboxamide
CID 79637456
3-(4-iodopyrazol-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79638137
1-amino-3-(1-methylpyrazol-4-yl)sulfanylcyclohexane-1-carboxamide
CID 79634834
1-amino-3-(4-bromo-3,5-dimethylpyrazol-1-yl)cyclohexane-1-carboxamide
CID 79637457
3-(4-chloropyrazol-1-yl)-1-(cyclopropylamino)cyclohexane-1-carboxamide
CID 79637451
4-[2-[(3S)-3-(4-methylpyrazol-1-yl)piperidin-1-yl]-2-oxoethoxy]benzamide
CID 95383166
1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide
CID 79650821
3-(4-chloropyrazol-1-yl)-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79651397

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide?
The IUPAC name of 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide (CID 79637821) is 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide is Cc1cnn(C2CCCC(N)(C(N)=O)C2)c1.
What is the InChIKey of 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide?
The InChIKey is UUXLYHXJYZRJQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-8-6-14-15(7-8)9-3-2-4-11(13,5-9)10(12)16/h6-7,9H,2-5,13H2,1H3,(H2,12,16).
What are the key properties of 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide?
1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(4-methylpyrazol-1-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 79637821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).