[2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol

C12H14N4O — CID 83184637

IUPAC[2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol
SMILESCc1nc(-n2ccc(C3CC3)n2)ncc1CO
InChIInChI=1S/C12H14N4O/c1-8-10(7-17)6-13-12(14-8)16-5-4-11(15-16)9-2-3-9/h4-6,9,17H,2-3,7H2,1H3
InChIKeyZYWUSLCUCCTZLK-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.34
Rot. Bonds3

About [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol

[2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol (PubChem CID 83184637) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol
PubChem CID83184637
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name[2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol
SMILESCc1nc(-n2ccc(C3CC3)n2)ncc1CO
InChIInChI=1S/C12H14N4O/c1-8-10(7-17)6-13-12(14-8)16-5-4-11(15-16)9-2-3-9/h4-6,9,17H,2-3,7H2,1H3
InChIKeyZYWUSLCUCCTZLK-UHFFFAOYSA-N
XLogP1.34
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-Propan-2-yl-2-pyrazol-1-ylpyrimidine
CID 134968872
1-[1-(2-Methoxyethyl)-5-(trifluoromethyl)pyrazol-4-yl]-2-pyrimidin-2-ylethanol
CID 142541249
[1-[4-[(4,4-Difluorocyclohexyl)methyl]-6-methylpyrimidin-2-yl]-4-methylpyrazol-3-yl]methanol
CID 160127844
[1-[4-[(4,4-Difluorocyclohexyl)methyl]-6-methylpyrimidin-2-yl]pyrazol-3-yl]methanol
CID 161865307
[4-Methyl-2-[3-(trifluoromethyl)pyrazol-1-yl]pyrimidin-5-yl]methanol
CID 83184382
1-(1,2,4-Triazolo[1,5-a]pyrimidin-7-yl)ethanol
CID 10920851
(1R)-1-([1,2,4]triazolo[1,5-a]pyrimidin-7-yl)ethanol
CID 11126602
2-[3-(2-Methylpropyl)pyrazol-1-yl]pyrimidine
CID 20771879
[3-Methyl-1-(pyridin-2-yl)-1H-pyrazol-4-yl]methanol
CID 23076503
2-(3-Cyclopropylpyrazol-1-yl)pyrimidine
CID 23299970
1-([1,2,4]Triazolo[1,5-a]pyrimidin-5-yl)ethanol
CID 53853639
(S)-1-(1,2,4-triazolo[1,5-a]pyrimidin-7-yl)ethanol
CID 53998193

Frequently Asked Questions

What is the IUPAC name of [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol?
The IUPAC name of [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol (CID 83184637) is [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol.
What is the SMILES notation for [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol?
The canonical SMILES for [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol is Cc1nc(-n2ccc(C3CC3)n2)ncc1CO.
What is the InChIKey of [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol?
The InChIKey is ZYWUSLCUCCTZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-8-10(7-17)6-13-12(14-8)16-5-4-11(15-16)9-2-3-9/h4-6,9,17H,2-3,7H2,1H3.
What are the key properties of [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol?
[2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol has a molecular weight of 230.27 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-cyclopropylpyrazol-1-yl)-4-methylpyrimidin-5-yl]methanol is sourced from PubChem (CID 83184637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).