[1-(2-methylpropyl)pyrazol-4-yl]methanol

C8H14N2O — CID 62729998

IUPAC[1-(2-methylpropyl)pyrazol-4-yl]methanol
SMILESCC(C)Cn1cc(CO)cn1
InChIInChI=1S/C8H14N2O/c1-7(2)4-10-5-8(6-11)3-9-10/h3,5,7,11H,4,6H2,1-2H3
InChIKeyZRRRTBZRVPFFJP-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.03
Rot. Bonds3

About [1-(2-methylpropyl)pyrazol-4-yl]methanol

[1-(2-methylpropyl)pyrazol-4-yl]methanol (PubChem CID 62729998) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is [1-(2-methylpropyl)pyrazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(2-methylpropyl)pyrazol-4-yl]methanol
PubChem CID62729998
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name[1-(2-methylpropyl)pyrazol-4-yl]methanol
SMILESCC(C)Cn1cc(CO)cn1
InChIInChI=1S/C8H14N2O/c1-7(2)4-10-5-8(6-11)3-9-10/h3,5,7,11H,4,6H2,1-2H3
InChIKeyZRRRTBZRVPFFJP-UHFFFAOYSA-N
XLogP1.03
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(2,2-difluoroethyl)pyrazol-4-yl]methyl]-1-[1-(2-methylpropyl)pyrazol-4-yl]methanamine
CID 122167670
1-[1-(2-methylpropyl)pyrazol-4-yl]ethanamine
CID 62729328
[1-(2-chloroethyl)pyrazol-4-yl]methanol
CID 4711793
2-amino-1-[1-(2-methylpropyl)pyrazol-4-yl]ethanol
CID 82407041
1-[1-(2-methylpropyl)pyrazol-4-yl]propan-1-one
CID 62728545
[1-(2-ethoxyethyl)pyrazol-4-yl]methanol
CID 62731815
2-fluoro-1-[1-(2-methylpropyl)pyrazol-4-yl]ethanone
CID 122192591
1-[1-(2-methylpropyl)pyrazol-4-yl]-3-sulfanylpropane-1,2-diol
CID 170821000
[1-[(4-tert-butylphenyl)methyl]pyrazol-4-yl]methanol
CID 55109077
N-[[1-(2-methylpropyl)pyrazol-4-yl]methyl]pyridin-2-amine
CID 95732873
3-methoxy-N-[[1-(2-methylpropyl)pyrazol-4-yl]methyl]propan-1-amine;hydrochloride
CID 126966892
N,N-dimethyl-4-[[[1-(2-methylpropyl)pyrazol-4-yl]methylamino]methyl]aniline;dihydrochloride
CID 126968221

Frequently Asked Questions

What is the IUPAC name of [1-(2-methylpropyl)pyrazol-4-yl]methanol?
The IUPAC name of [1-(2-methylpropyl)pyrazol-4-yl]methanol (CID 62729998) is [1-(2-methylpropyl)pyrazol-4-yl]methanol.
What is the SMILES notation for [1-(2-methylpropyl)pyrazol-4-yl]methanol?
The canonical SMILES for [1-(2-methylpropyl)pyrazol-4-yl]methanol is CC(C)Cn1cc(CO)cn1.
What is the InChIKey of [1-(2-methylpropyl)pyrazol-4-yl]methanol?
The InChIKey is ZRRRTBZRVPFFJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-7(2)4-10-5-8(6-11)3-9-10/h3,5,7,11H,4,6H2,1-2H3.
What are the key properties of [1-(2-methylpropyl)pyrazol-4-yl]methanol?
[1-(2-methylpropyl)pyrazol-4-yl]methanol has a molecular weight of 154.21 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylpropyl)pyrazol-4-yl]methanol is sourced from PubChem (CID 62729998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).