4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide

C13H22N4O — CID 114130686

IUPAC4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide
SMILESCc1cnn(CCNC(=O)C2CCC(N)CC2)c1
InChIInChI=1S/C13H22N4O/c1-10-8-16-17(9-10)7-6-15-13(18)11-2-4-12(14)5-3-11/h8-9,11-12H,2-7,14H2,1H3,(H,15,18)
InChIKeyVUHQLWBEVRVGHY-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.83
Rot. Bonds4

About 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide

4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide (PubChem CID 114130686) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide
PubChem CID114130686
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide
SMILESCc1cnn(CCNC(=O)C2CCC(N)CC2)c1
InChIInChI=1S/C13H22N4O/c1-10-8-16-17(9-10)7-6-15-13(18)11-2-4-12(14)5-3-11/h8-9,11-12H,2-7,14H2,1H3,(H,15,18)
InChIKeyVUHQLWBEVRVGHY-UHFFFAOYSA-N
XLogP0.83
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]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

cis-(1R,3S)-3-amino-N-[2-(4-chloropyrazol-1-yl)ethyl]cyclopentane-1-carboxamide
CID 133120673
1-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclopropane-1-carboxamide
CID 103950251
N-[2-(4-methylpyrazol-1-yl)ethyl]-3,4-dihydro-2H-chromene-3-carboxamide
CID 72909703
3-fluoro-N-[2-(4-methylpyrazol-1-yl)ethyl]azetidine-1-carboxamide
CID 126776995
4-amino-N-[2-(4-methyl-3-pyridinyl)ethyl]cyclohexane-1-carboxamide
CID 138057699
5-[2-(4-methylpyrazol-1-yl)ethylcarbamoyl]-4,5-dihydro-1,2-oxazole-3-carboxylic acid
CID 114131892
2-chloro-N-[2-(4-methylpyrazol-1-yl)ethyl]propanamide
CID 103881624
N-[3-(4-chloropyrazol-1-yl)propyl]cyclopropanecarboxamide
CID 19330222
1-[2-[(3-aminocyclopentanecarbonyl)amino]ethyl]triazole-4-carboxylic acid
CID 107500233
1-(aminomethyl)-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclobutane-1-carboxamide
CID 114130261
(3R,6S)-1-acetyl-6-amino-N-[3-(4-chloropyrazol-1-yl)propyl]azepane-3-carboxamide
CID 165421933
(3S)-1-N,1-N-dimethyl-3-N-[3-(4-methylpyrazol-1-yl)propyl]piperidine-1,3-dicarboxamide
CID 97193249

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide (CID 114130686) is 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide is Cc1cnn(CCNC(=O)C2CCC(N)CC2)c1.
What is the InChIKey of 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide?
The InChIKey is VUHQLWBEVRVGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-10-8-16-17(9-10)7-6-15-13(18)11-2-4-12(14)5-3-11/h8-9,11-12H,2-7,14H2,1H3,(H,15,18).
What are the key properties of 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide?
4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide has a molecular weight of 250.35 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 114130686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).