(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol

C14H18N2O2 — CID 63961553

IUPAC(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol
SMILESCCCOc1ccc(C(O)c2ccnn2C)cc1
InChIInChI=1S/C14H18N2O2/c1-3-10-18-12-6-4-11(5-7-12)14(17)13-8-9-15-16(13)2/h4-9,14,17H,3,10H2,1-2H3
InChIKeyYKUQKPPYZYUCLR-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.29
Rot. Bonds5

About (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol

(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol (PubChem CID 63961553) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol
PubChem CID63961553
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol
SMILESCCCOc1ccc(C(O)c2ccnn2C)cc1
InChIInChI=1S/C14H18N2O2/c1-3-10-18-12-6-4-11(5-7-12)14(17)13-8-9-15-16(13)2/h4-9,14,17H,3,10H2,1-2H3
InChIKeyYKUQKPPYZYUCLR-UHFFFAOYSA-N
XLogP2.29
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-butoxyphenyl)-(2-methylpyrazol-3-yl)methanol
CID 105098336
(2-methylpyrazol-3-yl)-(2-propoxyphenyl)methanol
CID 114554144
(2-methylpyrazol-3-yl)-(4-propan-2-yloxyphenyl)methanol
CID 63961352
(4-ethylphenyl)-(2-methylpyrazol-3-yl)methanol
CID 63962198
(2-methylpyrazol-3-yl)-[4-(trifluoromethoxy)phenyl]methanol
CID 63963696
(4-chlorophenyl)-(2-methylpyrazol-3-yl)methanol
CID 11550333
(3-ethylimidazol-4-yl)-(4-propoxyphenyl)methanol
CID 66135578
(4-ethylphenyl)-(4-propoxyphenyl)methanol
CID 62796114
(6-methyl-3-pyridinyl)-(4-propoxyphenyl)methanol
CID 63895736
furan-2-yl-(4-propoxyphenyl)methanol
CID 62796281
(4-butoxyphenyl)-(4-chloro-1-methylpyrazol-5-yl)methanol
CID 105129781
(4-bromo-1-methylpyrazol-5-yl)-(4-butoxyphenyl)methanol
CID 105132514

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol?
The IUPAC name of (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol (CID 63961553) is (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol.
What is the SMILES notation for (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol?
The canonical SMILES for (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol is CCCOc1ccc(C(O)c2ccnn2C)cc1.
What is the InChIKey of (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol?
The InChIKey is YKUQKPPYZYUCLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-3-10-18-12-6-4-11(5-7-12)14(17)13-8-9-15-16(13)2/h4-9,14,17H,3,10H2,1-2H3.
What are the key properties of (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol?
(2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol has a molecular weight of 246.31 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-(4-propoxyphenyl)methanol is sourced from PubChem (CID 63961553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).