4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol

C19H18FNO — CID 156880462

IUPAC4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol
SMILESCc1nc2cc(O)ccc2c(-c2ccc(F)cc2)c1C(C)C
InChIInChI=1S/C19H18FNO/c1-11(2)18-12(3)21-17-10-15(22)8-9-16(17)19(18)13-4-6-14(20)7-5-13/h4-11,22H,1-3H3
InChIKeyRLGRCQWGRVDCAS-UHFFFAOYSA-N
MW295.36 g/mol
LogP5.18
Rot. Bonds2

About 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol

4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol (PubChem CID 156880462) has the molecular formula C19H18FNO and a molecular weight of 295.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol
PubChem CID156880462
Molecular FormulaC19H18FNO
Molecular Weight295.36 g/mol
Exact Mass295.14
IUPAC Name4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol
SMILESCc1nc2cc(O)ccc2c(-c2ccc(F)cc2)c1C(C)C
InChIInChI=1S/C19H18FNO/c1-11(2)18-12(3)21-17-10-15(22)8-9-16(17)19(18)13-4-6-14(20)7-5-13/h4-11,22H,1-3H3
InChIKeyRLGRCQWGRVDCAS-UHFFFAOYSA-N
XLogP5.18
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.36
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-4-(4-fluorophenyl)-3-propan-2-ylquinolin-7-ol;3-hydroxypropanoic acid
CID 156880459
methyl 2-[[4-(4-fluorophenyl)-7-hydroxy-3-propan-2-ylquinolin-2-yl]amino]-2-methylpropanoate
CID 175395950
1-[[[4-(4-fluorophenyl)-7-hydroxy-3-propan-2-ylquinolin-2-yl]amino]methyl]cyclopropane-1-carboxylic acid
CID 156880509
4-chloro-7-fluoro-2-methyl-3-propan-2-ylquinoline
CID 103996066
(2R)-3-[4-(4-fluorophenyl)-7-hydroxy-3-(1-methoxypropan-2-yl)quinolin-2-yl]-2-methylpropanoic acid
CID 168754358
(2S)-3-[4-(4-fluorophenyl)-7-hydroxy-3-(1-methoxypropan-2-yl)quinolin-2-yl]-2-methylpropanoic acid
CID 168754342
3-[[4-(4-fluoro-3-methylphenyl)-7-hydroxy-3-propan-2-ylquinolin-2-yl]amino]cyclobutane-1-carboxylic acid
CID 156880068
6-fluoro-N,2-dimethyl-3-propan-2-ylquinolin-4-amine
CID 62913667
1-[6-bromo-4-(4-fluorophenyl)-2-methylquinolin-3-yl]ethanol;1-[6-bromo-4-(4-fluorophenyl)-2-methylquinolin-3-yl]ethanone
CID 157054972
2-[4-(4-fluorophenyl)-7-hydroxy-3-propan-2-ylisoquinolin-1-yl]oxypropanoic acid
CID 156880161
4-chloro-5,7-difluoro-2-methyl-3-propan-2-ylquinoline
CID 63409144
7-(methoxymethoxy)-2-methyl-4-(2-methyl-4-pyridinyl)-3-propan-2-ylquinoline
CID 156880216

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol?
The IUPAC name of 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol (CID 156880462) is 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol.
What is the SMILES notation for 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol?
The canonical SMILES for 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol is Cc1nc2cc(O)ccc2c(-c2ccc(F)cc2)c1C(C)C.
What is the InChIKey of 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol?
The InChIKey is RLGRCQWGRVDCAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FNO/c1-11(2)18-12(3)21-17-10-15(22)8-9-16(17)19(18)13-4-6-14(20)7-5-13/h4-11,22H,1-3H3.
What are the key properties of 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol?
4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol has a molecular weight of 295.36 g/mol, XLogP of 5.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-methyl-3-propan-2-ylquinolin-7-ol is sourced from PubChem (CID 156880462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).