[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol

C12H15N3O — CID 66437686

IUPAC[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol
SMILESCCc1c(CO)cnn1-c1cc(C)ccn1
InChIInChI=1S/C12H15N3O/c1-3-11-10(8-16)7-14-15(11)12-6-9(2)4-5-13-12/h4-7,16H,3,8H2,1-2H3
InChIKeyINYBUCKFVSGFOC-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.63
Rot. Bonds3

About [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol

[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol (PubChem CID 66437686) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol.

Molecular Properties

Compound Name[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol
PubChem CID66437686
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol
SMILESCCc1c(CO)cnn1-c1cc(C)ccn1
InChIInChI=1S/C12H15N3O/c1-3-11-10(8-16)7-14-15(11)12-6-9(2)4-5-13-12/h4-7,16H,3,8H2,1-2H3
InChIKeyINYBUCKFVSGFOC-UHFFFAOYSA-N
XLogP1.63
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol?
The IUPAC name of [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol (CID 66437686) is [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol.
What is the SMILES notation for [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol?
The canonical SMILES for [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol is CCc1c(CO)cnn1-c1cc(C)ccn1.
What is the InChIKey of [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol?
The InChIKey is INYBUCKFVSGFOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-3-11-10(8-16)7-14-15(11)12-6-9(2)4-5-13-12/h4-7,16H,3,8H2,1-2H3.
What are the key properties of [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol?
[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol has a molecular weight of 217.27 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol is sourced from PubChem (CID 66437686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).