2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol

C12H21N3O — CID 115653189

IUPAC2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol
SMILESCc1cc(NC2CCCCC2)n(CCO)n1
InChIInChI=1S/C12H21N3O/c1-10-9-12(15(14-10)7-8-16)13-11-5-3-2-4-6-11/h9,11,13,16H,2-8H2,1H3
InChIKeyVLHMDBONQRLXQW-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.93
Rot. Bonds4

About 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol

2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol (PubChem CID 115653189) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol
PubChem CID115653189
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol
SMILESCc1cc(NC2CCCCC2)n(CCO)n1
InChIInChI=1S/C12H21N3O/c1-10-9-12(15(14-10)7-8-16)13-11-5-3-2-4-6-11/h9,11,13,16H,2-8H2,1H3
InChIKeyVLHMDBONQRLXQW-UHFFFAOYSA-N
XLogP1.93
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol 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-cyclohexyl-3-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]urea
CID 47079357
2-[3-methyl-5-(thiolan-3-ylamino)pyrazol-1-yl]ethanol
CID 115925984
2-[5-(cyclopentylamino)-3-(2-methylfuran-3-yl)pyrazol-1-yl]ethanol
CID 110928779
N-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]piperidine-4-carboxamide
CID 110482309
N-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]-2-(methylamino)acetamide
CID 110479037
2-[3-methyl-5-(4-methylpentan-2-ylamino)pyrazol-1-yl]ethanol
CID 115925989
N-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]-3-methylbutanamide
CID 110479535
2-[5-(3-methoxybutan-2-ylamino)-3-methylpyrazol-1-yl]ethanol
CID 115925988
2-amino-N-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]-3-methylbutanamide
CID 110481411
1-[2-(2-hydroxyethyl)-5-methylpyrazol-3-yl]-3-phenylurea
CID 110483127
N-cyclohexyl-5-ethyl-1-(2-hydroxyethyl)pyrazole-3-carboxamide
CID 142991730
1-cyclohexyl-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]urea
CID 19575124

Frequently Asked Questions

What is the IUPAC name of 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol?
The IUPAC name of 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol (CID 115653189) is 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol?
The canonical SMILES for 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol is Cc1cc(NC2CCCCC2)n(CCO)n1.
What is the InChIKey of 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol?
The InChIKey is VLHMDBONQRLXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-10-9-12(15(14-10)7-8-16)13-11-5-3-2-4-6-11/h9,11,13,16H,2-8H2,1H3.
What are the key properties of 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol?
2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol has a molecular weight of 223.32 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(cyclohexylamino)-3-methylpyrazol-1-yl]ethanol is sourced from PubChem (CID 115653189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).