(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol

C9H12N4O — CID 66116496

IUPAC(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol
SMILESCn1cc(C(O)c2cncn2C)cn1
InChIInChI=1S/C9H12N4O/c1-12-6-10-4-8(12)9(14)7-3-11-13(2)5-7/h3-6,9,14H,1-2H3
InChIKeyRCYPODUDCXJEOA-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.24
Rot. Bonds2

About (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol

(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol (PubChem CID 66116496) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol
PubChem CID66116496
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol
SMILESCn1cc(C(O)c2cncn2C)cn1
InChIInChI=1S/C9H12N4O/c1-12-6-10-4-8(12)9(14)7-3-11-13(2)5-7/h3-6,9,14H,1-2H3
InChIKeyRCYPODUDCXJEOA-UHFFFAOYSA-N
XLogP0.24
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-methylimidazol-4-yl)-(1-propylpyrazol-4-yl)methanol
CID 66118416
furan-3-yl-(3-methylimidazol-4-yl)methanol
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(3-ethyl-1-methylpyrazol-5-yl)-(1-methylpyrazol-4-yl)methanol
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(3-methylimidazol-4-yl)-(5-methylthiophen-3-yl)methanol
CID 66116920
(3-methylimidazol-4-yl)-naphthalen-2-ylmethanol
CID 66116281
(1-methylpyrazol-4-yl)-(5-methyl-3-pyridinyl)methanol
CID 115373634
(4-ethoxyphenyl)-(3-methylimidazol-4-yl)methanol
CID 66118611
(3,4-dimethoxyphenyl)-(3-methylimidazol-4-yl)methanol
CID 66116292
(4-chlorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 61088026
(2-fluorophenyl)-(1-methylpyrazol-4-yl)methanol
CID 61088379
(2,5-dimethylthiophen-3-yl)-(1-methylpyrazol-4-yl)methanol
CID 63901158
3,4-dihydro-2H-pyran-6-yl-(3-methylimidazol-4-yl)methanol
CID 102646615

Frequently Asked Questions

What is the IUPAC name of (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol?
The IUPAC name of (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol (CID 66116496) is (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol.
What is the SMILES notation for (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol?
The canonical SMILES for (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol is Cn1cc(C(O)c2cncn2C)cn1.
What is the InChIKey of (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol?
The InChIKey is RCYPODUDCXJEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O/c1-12-6-10-4-8(12)9(14)7-3-11-13(2)5-7/h3-6,9,14H,1-2H3.
What are the key properties of (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol?
(3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol has a molecular weight of 192.22 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylimidazol-4-yl)-(1-methylpyrazol-4-yl)methanol is sourced from PubChem (CID 66116496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).