[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol

C12H21N3O — CID 82866192

IUPAC[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol
SMILESCn1ccc(CNC2(CO)CCCCC2)n1
InChIInChI=1S/C12H21N3O/c1-15-8-5-11(14-15)9-13-12(10-16)6-3-2-4-7-12/h5,8,13,16H,2-4,6-7,9-10H2,1H3
InChIKeyISBMUXLEUOLHIT-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.20
Rot. Bonds4

About [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol

[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol (PubChem CID 82866192) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol
PubChem CID82866192
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol
SMILESCn1ccc(CNC2(CO)CCCCC2)n1
InChIInChI=1S/C12H21N3O/c1-15-8-5-11(14-15)9-13-12(10-16)6-3-2-4-7-12/h5,8,13,16H,2-4,6-7,9-10H2,1H3
InChIKeyISBMUXLEUOLHIT-UHFFFAOYSA-N
XLogP1.20
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 ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol 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-[(1-methylpyrrol-3-yl)methylamino]cyclohexyl]methanol
CID 66400249
4-(chloromethyl)-N-[(1-methylpyrazol-3-yl)methyl]oxan-4-amine
CID 106299901
[1-[(1-phenylpyrazol-3-yl)methylamino]cyclopropyl]methanol
CID 115897888
[1-[(1-methylpyrrol-3-yl)methylamino]cyclopentyl]methanol
CID 66400247
N-[(1-methylcyclobutyl)methyl]-1-(1-methylpyrazol-3-yl)methanamine;hydrochloride
CID 115680433
[1-[(6-methyl-2-pyridinyl)methylamino]cyclopentyl]methanol
CID 79268223
[1-(pyrimidin-4-ylmethylamino)cyclohexyl]methanol
CID 62747313
1-[(1-methylpyrazol-3-yl)methyl]cyclooctane-1-carboxylic acid
CID 82872075
1-[1-(hydroxymethyl)cyclopentyl]-3-(1-methylpyrazol-3-yl)urea
CID 111926215
[1-(1,3-thiazol-4-ylmethylamino)cyclohexyl]methanol
CID 62521702
1-cyano-N-[(1-methylpyrazol-3-yl)methyl]cyclopentane-1-carboxamide
CID 82873497
1-amino-N-[(1-methylpyrazol-3-yl)methyl]cyclobutane-1-carboxamide
CID 82873363

Frequently Asked Questions

What is the IUPAC name of [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol?
The IUPAC name of [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol (CID 82866192) is [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol.
What is the SMILES notation for [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol?
The canonical SMILES for [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol is Cn1ccc(CNC2(CO)CCCCC2)n1.
What is the InChIKey of [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol?
The InChIKey is ISBMUXLEUOLHIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-15-8-5-11(14-15)9-13-12(10-16)6-3-2-4-7-12/h5,8,13,16H,2-4,6-7,9-10H2,1H3.
What are the key properties of [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol?
[1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol has a molecular weight of 223.32 g/mol, XLogP of 1.20, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1-methylpyrazol-3-yl)methylamino]cyclohexyl]methanol is sourced from PubChem (CID 82866192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).