1-phenyl-2-quinolin-8-ylbutan-2-ol

C19H19NO — CID 81196654

IUPAC1-phenyl-2-quinolin-8-ylbutan-2-ol
SMILESCCC(O)(Cc1ccccc1)c1cccc2cccnc12
InChIInChI=1S/C19H19NO/c1-2-19(21,14-15-8-4-3-5-9-15)17-12-6-10-16-11-7-13-20-18(16)17/h3-13,21H,2,14H2,1H3
InChIKeyWKMUUTQCLAVSOS-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.08
Rot. Bonds4

About 1-phenyl-2-quinolin-8-ylbutan-2-ol

1-phenyl-2-quinolin-8-ylbutan-2-ol (PubChem CID 81196654) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-phenyl-2-quinolin-8-ylbutan-2-ol.

Molecular Properties

Compound Name1-phenyl-2-quinolin-8-ylbutan-2-ol
PubChem CID81196654
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name1-phenyl-2-quinolin-8-ylbutan-2-ol
SMILESCCC(O)(Cc1ccccc1)c1cccc2cccnc12
InChIInChI=1S/C19H19NO/c1-2-19(21,14-15-8-4-3-5-9-15)17-12-6-10-16-11-7-13-20-18(16)17/h3-13,21H,2,14H2,1H3
InChIKeyWKMUUTQCLAVSOS-UHFFFAOYSA-N
XLogP4.08
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-quinolin-5-ylbutan-2-ol
CID 81196790
2-(4-methoxyphenyl)-1-phenylbutan-2-ol
CID 79008309
5-methyl-2-quinolin-8-ylhexan-2-ol
CID 114280033
2-phenyl-1-quinolin-8-ylethanone
CID 10999362
2-quinolin-8-ylpropane-2-thiol
CID 123447185
2,3-dimethyl-2-(quinolin-8-ylmethyl)butanoic acid
CID 83149658
2-(1-methylpyrazol-4-yl)-1-phenylbutan-2-ol
CID 79007571
2-[(4-methoxyphenyl)methyl]-2-methyl-N-quinolin-8-ylbutanamide
CID 102136715
2-benzyl-3-(4-methoxyphenyl)-2-[(3-methoxyphenyl)methyl]-N-quinolin-8-ylpropanamide
CID 102136704
azane;3-benzylpentan-3-ol
CID 173295411
methanol;quinolin-8-ol
CID 161490698
1-(3-fluorophenyl)-2-quinolin-8-ylpropan-2-amine
CID 114833985

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-quinolin-8-ylbutan-2-ol?
The IUPAC name of 1-phenyl-2-quinolin-8-ylbutan-2-ol (CID 81196654) is 1-phenyl-2-quinolin-8-ylbutan-2-ol.
What is the SMILES notation for 1-phenyl-2-quinolin-8-ylbutan-2-ol?
The canonical SMILES for 1-phenyl-2-quinolin-8-ylbutan-2-ol is CCC(O)(Cc1ccccc1)c1cccc2cccnc12.
What is the InChIKey of 1-phenyl-2-quinolin-8-ylbutan-2-ol?
The InChIKey is WKMUUTQCLAVSOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-2-19(21,14-15-8-4-3-5-9-15)17-12-6-10-16-11-7-13-20-18(16)17/h3-13,21H,2,14H2,1H3.
What are the key properties of 1-phenyl-2-quinolin-8-ylbutan-2-ol?
1-phenyl-2-quinolin-8-ylbutan-2-ol has a molecular weight of 277.37 g/mol, XLogP of 4.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-quinolin-8-ylbutan-2-ol is sourced from PubChem (CID 81196654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).