(4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol

C15H14N2O3 — CID 175318879

IUPAC(4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol
SMILESCOc1ccnc2c1ccc1c(OC)cc(CO)nc12
InChIInChI=1S/C15H14N2O3/c1-19-12-5-6-16-14-10(12)3-4-11-13(20-2)7-9(8-18)17-15(11)14/h3-7,18H,8H2,1-2H3
InChIKeyBRUVXFIOXQHXJM-UHFFFAOYSA-N
MW270.29 g/mol
LogP2.29
Rot. Bonds3

About (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol

(4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol (PubChem CID 175318879) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol.

Molecular Properties

Compound Name(4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol
PubChem CID175318879
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name(4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol
SMILESCOc1ccnc2c1ccc1c(OC)cc(CO)nc12
InChIInChI=1S/C15H14N2O3/c1-19-12-5-6-16-14-10(12)3-4-11-13(20-2)7-9(8-18)17-15(11)14/h3-7,18H,8H2,1-2H3
InChIKeyBRUVXFIOXQHXJM-UHFFFAOYSA-N
XLogP2.29
TPSA64.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

2,9-diethyl-4,7-dimethoxy-1,10-phenanthroline
CID 102487676
4-methoxy-8-methylquinolin-7-ol
CID 143166925
(5,8-dimethoxyquinolin-2-yl)methanamine
CID 82241956
(8-methoxyquinolin-4-yl)methanol
CID 86714571
dichloromethane;5-fluoro-4-methoxy-1,10-phenanthroline-2-carbaldehyde;(5-fluoro-4-methoxy-1,10-phenanthrolin-2-yl)methanol
CID 158819225
(3-bromo-4-methoxy-2-pyridinyl)methanol
CID 14402959
8-hydroxysulfanyl-4-methoxyquinoline
CID 176668017
[6-(difluoromethyl)-5-fluoro-4-methoxy-2-pyridinyl]methanol
CID 118809132
5-methoxy-1,7-phenanthroline
CID 67576947
4,7-dimethoxyquinoline
CID 20743716
methyl 2-(hydroxymethyl)-8-methoxyquinoline-6-carboxylate
CID 156872967
[2-(2-methoxyphenyl)pyrimidin-4-yl]methanol
CID 62748662

Frequently Asked Questions

What is the IUPAC name of (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol?
The IUPAC name of (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol (CID 175318879) is (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol.
What is the SMILES notation for (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol?
The canonical SMILES for (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol is COc1ccnc2c1ccc1c(OC)cc(CO)nc12.
What is the InChIKey of (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol?
The InChIKey is BRUVXFIOXQHXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-19-12-5-6-16-14-10(12)3-4-11-13(20-2)7-9(8-18)17-15(11)14/h3-7,18H,8H2,1-2H3.
What are the key properties of (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol?
(4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol has a molecular weight of 270.29 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4,7-dimethoxy-1,10-phenanthrolin-2-yl)methanol is sourced from PubChem (CID 175318879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).