7-[amino(phenyl)methyl]quinolin-8-ol

C16H14N2O — CID 118080370

IUPAC7-[amino(phenyl)methyl]quinolin-8-ol
SMILESNC(c1ccccc1)c1ccc2cccnc2c1O
InChIInChI=1S/C16H14N2O/c17-14(11-5-2-1-3-6-11)13-9-8-12-7-4-10-18-15(12)16(13)19/h1-10,14,19H,17H2
InChIKeyCRJOPRYHOIJMHH-UHFFFAOYSA-N
MW250.30 g/mol
LogP2.99
Rot. Bonds2

About 7-[amino(phenyl)methyl]quinolin-8-ol

7-[amino(phenyl)methyl]quinolin-8-ol (PubChem CID 118080370) has the molecular formula C16H14N2O and a molecular weight of 250.30 g/mol. Its IUPAC name is 7-[amino(phenyl)methyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[amino(phenyl)methyl]quinolin-8-ol
PubChem CID118080370
Molecular FormulaC16H14N2O
Molecular Weight250.30 g/mol
Exact Mass250.11
IUPAC Name7-[amino(phenyl)methyl]quinolin-8-ol
SMILESNC(c1ccccc1)c1ccc2cccnc2c1O
InChIInChI=1S/C16H14N2O/c17-14(11-5-2-1-3-6-11)13-9-8-12-7-4-10-18-15(12)16(13)19/h1-10,14,19H,17H2
InChIKeyCRJOPRYHOIJMHH-UHFFFAOYSA-N
XLogP2.99
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

7-[amino(phenyl)methyl]quinolin-8-amine
CID 174698736
(8-hydroxyquinolin-7-yl)methanediol
CID 145367917
7-[1-(3-fluorophenyl)-2-pyridin-2-ylethyl]quinolin-8-ol
CID 58542815
4-chloro-N-[(8-hydroxyquinolin-7-yl)-phenylmethyl]benzamide
CID 146475092
4-fluoro-N-[(8-hydroxyquinolin-7-yl)-phenylmethyl]benzamide
CID 146474891
7-[(2-hydroxyanilino)-pyridin-3-ylmethyl]quinolin-8-ol
CID 4130526
7-[1-(3,5-dichlorophenyl)-2-pyridin-2-ylethyl]quinolin-8-ol
CID 58543199
methyl 2-[[(R)-(8-hydroxyquinolin-7-yl)-phenylmethyl]amino]benzoate
CID 6962939
7-[phenyl-[3-(trifluoromethyl)anilino]methyl]quinolin-8-ol
CID 3056881
N-[(8-hydroxyquinolin-7-yl)-phenylmethyl]quinoline-3-carboxamide
CID 146474860
7-[(2-hydroxyanilino)-pyridin-1-ium-3-ylmethyl]quinolin-8-ol
CID 4130528
N-[(S)-(8-hydroxyquinolin-7-yl)-naphthalen-2-ylmethyl]benzamide
CID 2173643

Frequently Asked Questions

What is the IUPAC name of 7-[amino(phenyl)methyl]quinolin-8-ol?
The IUPAC name of 7-[amino(phenyl)methyl]quinolin-8-ol (CID 118080370) is 7-[amino(phenyl)methyl]quinolin-8-ol.
What is the SMILES notation for 7-[amino(phenyl)methyl]quinolin-8-ol?
The canonical SMILES for 7-[amino(phenyl)methyl]quinolin-8-ol is NC(c1ccccc1)c1ccc2cccnc2c1O.
What is the InChIKey of 7-[amino(phenyl)methyl]quinolin-8-ol?
The InChIKey is CRJOPRYHOIJMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c17-14(11-5-2-1-3-6-11)13-9-8-12-7-4-10-18-15(12)16(13)19/h1-10,14,19H,17H2.
What are the key properties of 7-[amino(phenyl)methyl]quinolin-8-ol?
7-[amino(phenyl)methyl]quinolin-8-ol has a molecular weight of 250.30 g/mol, XLogP of 2.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[amino(phenyl)methyl]quinolin-8-ol is sourced from PubChem (CID 118080370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).