(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol

C15H17NO4 — CID 105066374

IUPAC(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol
SMILESCOc1cc(OC)cc(C(O)c2ccncc2OC)c1
InChIInChI=1S/C15H17NO4/c1-18-11-6-10(7-12(8-11)19-2)15(17)13-4-5-16-9-14(13)20-3/h4-9,15,17H,1-3H3
InChIKeyADFFORPELHQKNH-UHFFFAOYSA-N
MW275.30 g/mol
LogP2.19
Rot. Bonds5

About (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol

(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol (PubChem CID 105066374) has the molecular formula C15H17NO4 and a molecular weight of 275.30 g/mol. Its IUPAC name is (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol
PubChem CID105066374
Molecular FormulaC15H17NO4
Molecular Weight275.30 g/mol
Exact Mass275.12
IUPAC Name(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol
SMILESCOc1cc(OC)cc(C(O)c2ccncc2OC)c1
InChIInChI=1S/C15H17NO4/c1-18-11-6-10(7-12(8-11)19-2)15(17)13-4-5-16-9-14(13)20-3/h4-9,15,17H,1-3H3
InChIKeyADFFORPELHQKNH-UHFFFAOYSA-N
XLogP2.19
TPSA60.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-methoxy-4-pyridinyl)-[3-(trifluoromethoxy)phenyl]methanol
CID 105066282
(4-tert-butylphenyl)-(3-methoxy-4-pyridinyl)methanol
CID 105066253
(5-fluoro-3-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
CID 105066191
(4-chloro-2-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 115821652
1-(3-methoxy-4-pyridinyl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105065961
(3-methoxy-4-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105066395
[3-fluoro-4-(trifluoromethyl)phenyl]-(3-methoxy-4-pyridinyl)methanol
CID 107292052
(3-methoxy-2-pyridinyl)-(3-methoxy-4-pyridinyl)methanol
CID 114054869
2-(3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanol
CID 105066229
(3-chloro-4-pyridinyl)-(2,4-dimethoxyphenyl)methanol
CID 105095989
(3-methoxy-4-pyridinyl)-(5-methylthiophen-2-yl)methanol
CID 105066346
(2-amino-3-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 107469497

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol?
The IUPAC name of (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol (CID 105066374) is (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol.
What is the SMILES notation for (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol?
The canonical SMILES for (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol is COc1cc(OC)cc(C(O)c2ccncc2OC)c1.
What is the InChIKey of (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol?
The InChIKey is ADFFORPELHQKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4/c1-18-11-6-10(7-12(8-11)19-2)15(17)13-4-5-16-9-14(13)20-3/h4-9,15,17H,1-3H3.
What are the key properties of (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol?
(3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol has a molecular weight of 275.30 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxyphenyl)-(3-methoxy-4-pyridinyl)methanol is sourced from PubChem (CID 105066374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).