(5-cyclobutyl-1-methylpyrazol-3-yl)methanol

C9H14N2O — CID 164719502

IUPAC(5-cyclobutyl-1-methylpyrazol-3-yl)methanol
SMILESCn1nc(CO)cc1C1CCC1
InChIInChI=1S/C9H14N2O/c1-11-9(7-3-2-4-7)5-8(6-12)10-11/h5,7,12H,2-4,6H2,1H3
InChIKeyKIEMVDJWUWDRJN-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.18
Rot. Bonds2

About (5-cyclobutyl-1-methylpyrazol-3-yl)methanol

(5-cyclobutyl-1-methylpyrazol-3-yl)methanol (PubChem CID 164719502) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is (5-cyclobutyl-1-methylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(5-cyclobutyl-1-methylpyrazol-3-yl)methanol
PubChem CID164719502
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name(5-cyclobutyl-1-methylpyrazol-3-yl)methanol
SMILESCn1nc(CO)cc1C1CCC1
InChIInChI=1S/C9H14N2O/c1-11-9(7-3-2-4-7)5-8(6-12)10-11/h5,7,12H,2-4,6H2,1H3
InChIKeyKIEMVDJWUWDRJN-UHFFFAOYSA-N
XLogP1.18
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol
CID 165441976
1-(5-cyclopropyl-1-methylpyrazol-3-yl)propan-2-amine
CID 105438342
5-cyclohexyl-1-methylpyrazol-3-amine
CID 83696183
5-cyclohexyl-1-methylpyrazole-3-carbaldehyde
CID 83818201
5-cyclobutyl-N-cyclopropyl-1-methylpyrazol-3-amine
CID 116827598
4-(3-benzyl-1-methylpyrazol-5-yl)piperidine
CID 18187656
[5-cyclopropyl-1-(2,4,6-trimethylphenyl)pyrazol-3-yl]methanol
CID 82089024
(2S)-1-[(5-cyclopropyl-1-methylpyrazol-3-yl)methylsulfamoyl]pyrrolidine-2-carboxylic acid
CID 167962296
5-cyclohexyl-N,1-dimethylpyrazol-3-amine
CID 116827500
N-(5-cyclohexyl-1-methylpyrazol-3-yl)cyclobutanecarboxamide
CID 164792338
2-(5-cyclopentyl-1-methylpyrazol-3-yl)propanoic acid
CID 105479308
(5-ethyl-1-methylpyrazol-3-yl)methanol
CID 23005581

Frequently Asked Questions

What is the IUPAC name of (5-cyclobutyl-1-methylpyrazol-3-yl)methanol?
The IUPAC name of (5-cyclobutyl-1-methylpyrazol-3-yl)methanol (CID 164719502) is (5-cyclobutyl-1-methylpyrazol-3-yl)methanol.
What is the SMILES notation for (5-cyclobutyl-1-methylpyrazol-3-yl)methanol?
The canonical SMILES for (5-cyclobutyl-1-methylpyrazol-3-yl)methanol is Cn1nc(CO)cc1C1CCC1.
What is the InChIKey of (5-cyclobutyl-1-methylpyrazol-3-yl)methanol?
The InChIKey is KIEMVDJWUWDRJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-11-9(7-3-2-4-7)5-8(6-12)10-11/h5,7,12H,2-4,6H2,1H3.
What are the key properties of (5-cyclobutyl-1-methylpyrazol-3-yl)methanol?
(5-cyclobutyl-1-methylpyrazol-3-yl)methanol has a molecular weight of 166.22 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclobutyl-1-methylpyrazol-3-yl)methanol is sourced from PubChem (CID 164719502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).