(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol

C17H19NO2 — CID 105131446

IUPAC(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)c2ccc(OC3CC3)cc2)c(C)n1
InChIInChI=1S/C17H19NO2/c1-11-3-10-16(12(2)18-11)17(19)13-4-6-14(7-5-13)20-15-8-9-15/h3-7,10,15,17,19H,8-9H2,1-2H3
InChIKeyKSJWGHFNRNXJHE-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.32
Rot. Bonds4

About (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol

(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol (PubChem CID 105131446) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol
PubChem CID105131446
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol
SMILESCc1ccc(C(O)c2ccc(OC3CC3)cc2)c(C)n1
InChIInChI=1S/C17H19NO2/c1-11-3-10-16(12(2)18-11)17(19)13-4-6-14(7-5-13)20-15-8-9-15/h3-7,10,15,17,19H,8-9H2,1-2H3
InChIKeyKSJWGHFNRNXJHE-UHFFFAOYSA-N
XLogP3.32
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dimethyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanol
CID 115604819
(4-cyclopropyloxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115838353
(2-bromo-4-methylphenyl)-(4-cyclopropyloxyphenyl)methanol
CID 114518704
(4-cyclopropyloxyphenyl)-(2-methoxy-4-methylphenyl)methanol
CID 106791062
(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502
bis(2,6-dimethyl-3-pyridinyl)methanol
CID 141423650
(4-cyclopropyloxyphenyl)-(2,4-difluoro-5-methylphenyl)methanol
CID 115838370
(4-cyclopropyloxyphenyl)-(5-methyl-2-pyridinyl)methanol
CID 114518682
(4-cyclopropyloxyphenyl)-(4-cyclopropylphenyl)methanol
CID 114518662
(4-cyclopropyloxyphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 114518560
(4-cyclopropyloxyphenyl)-[2-(methoxymethyl)phenyl]methanol
CID 114518627
1-(4-cyclopropyloxyphenyl)-2-methylsulfanylethanol
CID 114519028

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
The IUPAC name of (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol (CID 105131446) is (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol.
What is the SMILES notation for (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
The canonical SMILES for (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol is Cc1ccc(C(O)c2ccc(OC3CC3)cc2)c(C)n1.
What is the InChIKey of (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
The InChIKey is KSJWGHFNRNXJHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-11-3-10-16(12(2)18-11)17(19)13-4-6-14(7-5-13)20-15-8-9-15/h3-7,10,15,17,19H,8-9H2,1-2H3.
What are the key properties of (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol?
(4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol has a molecular weight of 269.34 g/mol, XLogP of 3.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyloxyphenyl)-(2,6-dimethyl-3-pyridinyl)methanol is sourced from PubChem (CID 105131446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).