(2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol

C17H16N2O2 — CID 107469424

IUPAC(2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol
SMILESCOc1cccc(C(O)c2ccc3cccnc3c2)c1N
InChIInChI=1S/C17H16N2O2/c1-21-15-6-2-5-13(16(15)18)17(20)12-8-7-11-4-3-9-19-14(11)10-12/h2-10,17,20H,18H2,1H3
InChIKeySGRUKJBGUOMZPC-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.91
Rot. Bonds3

About (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol

(2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol (PubChem CID 107469424) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol.

Molecular Properties

Compound Name(2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol
PubChem CID107469424
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name(2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol
SMILESCOc1cccc(C(O)c2ccc3cccnc3c2)c1N
InChIInChI=1S/C17H16N2O2/c1-21-15-6-2-5-13(16(15)18)17(20)12-8-7-11-4-3-9-19-14(11)10-12/h2-10,17,20H,18H2,1H3
InChIKeySGRUKJBGUOMZPC-UHFFFAOYSA-N
XLogP2.91
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(4-methoxy-3-methylphenyl)-quinolin-7-ylmethanol
CID 81198121
(2-amino-3-methoxyphenyl)-(3,4-dimethylphenyl)methanol
CID 107469517
(3-bromo-4-methoxyphenyl)-quinolin-7-ylmethanol
CID 81196495
(2-bromophenyl)-quinolin-7-ylmethanol
CID 81216340
(2-chlorophenyl)-quinolin-7-ylmethanol
CID 81216556
(2-amino-3-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 107469497
(3-bromo-2-fluorophenyl)-quinolin-7-ylmethanol
CID 107954092
(2-bromo-3-fluorophenyl)-quinolin-7-ylmethanol
CID 115827043
(4-methylsulfanylphenyl)-quinolin-7-ylmethanol
CID 115827020
(2-amino-3-methoxyphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 107469372
(2-amino-3-pyridinyl)-(3-chloro-4-methoxyphenyl)methanol
CID 65026646
(5-bromo-2-methylphenyl)-quinolin-7-ylmethanol
CID 115827006

Frequently Asked Questions

What is the IUPAC name of (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol?
The IUPAC name of (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol (CID 107469424) is (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol.
What is the SMILES notation for (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol?
The canonical SMILES for (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol is COc1cccc(C(O)c2ccc3cccnc3c2)c1N.
What is the InChIKey of (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol?
The InChIKey is SGRUKJBGUOMZPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-21-15-6-2-5-13(16(15)18)17(20)12-8-7-11-4-3-9-19-14(11)10-12/h2-10,17,20H,18H2,1H3.
What are the key properties of (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol?
(2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol has a molecular weight of 280.33 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-methoxyphenyl)-quinolin-7-ylmethanol is sourced from PubChem (CID 107469424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).