4-chloro-5,7-dimethoxy-2-phenylquinoline

C17H14ClNO2 — CID 43668662

IUPAC4-chloro-5,7-dimethoxy-2-phenylquinoline
SMILESCOc1cc(OC)c2c(Cl)cc(-c3ccccc3)nc2c1
InChIInChI=1S/C17H14ClNO2/c1-20-12-8-15-17(16(9-12)21-2)13(18)10-14(19-15)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKeyBNHUZAMXVXVPKD-UHFFFAOYSA-N
MW299.76 g/mol
LogP4.57
Rot. Bonds3

About 4-chloro-5,7-dimethoxy-2-phenylquinoline

4-chloro-5,7-dimethoxy-2-phenylquinoline (PubChem CID 43668662) has the molecular formula C17H14ClNO2 and a molecular weight of 299.76 g/mol. Its IUPAC name is 4-chloro-5,7-dimethoxy-2-phenylquinoline.

Molecular Properties

Compound Name4-chloro-5,7-dimethoxy-2-phenylquinoline
PubChem CID43668662
Molecular FormulaC17H14ClNO2
Molecular Weight299.76 g/mol
Exact Mass299.07
IUPAC Name4-chloro-5,7-dimethoxy-2-phenylquinoline
SMILESCOc1cc(OC)c2c(Cl)cc(-c3ccccc3)nc2c1
InChIInChI=1S/C17H14ClNO2/c1-20-12-8-15-17(16(9-12)21-2)13(18)10-14(19-15)11-6-4-3-5-7-11/h3-10H,1-2H3
InChIKeyBNHUZAMXVXVPKD-UHFFFAOYSA-N
XLogP4.57
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.76
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-5,7-dimethoxy-2-methylquinoline
CID 43668663
2-chloro-5,7-dimethoxy-3-phenylquinoxaline
CID 10542283
4-chloro-2-(3-chloro-4-methoxyphenyl)quinoline
CID 18432969
4-iodo-7-methoxy-2-phenylquinoline
CID 143031618
5-ethyl-4-methoxy-2-phenylquinoline
CID 10400536
(7-methoxy-2-phenylquinolin-4-yl) hypofluorite
CID 143605848
4-(4-methoxyphenyl)-2-phenylquinoline
CID 12523263
2-(4-methoxyphenyl)-4,6-diphenylpyrimidine
CID 12706669
2-(4-methoxyphenyl)-4-[(2-methylpropan-2-yl)oxy]quinoline
CID 90459307
4,7-bis(2,4-dimethoxyphenyl)-2,9-diphenyl-1,10-phenanthroline
CID 70909545
4-tert-butyl-7-methoxy-2-phenylquinoline
CID 59716951
1-(2-chlorophenyl)-6,7-dimethoxy-3-(4-methoxyphenyl)isoquinoline
CID 1351974

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5,7-dimethoxy-2-phenylquinoline?
The IUPAC name of 4-chloro-5,7-dimethoxy-2-phenylquinoline (CID 43668662) is 4-chloro-5,7-dimethoxy-2-phenylquinoline.
What is the SMILES notation for 4-chloro-5,7-dimethoxy-2-phenylquinoline?
The canonical SMILES for 4-chloro-5,7-dimethoxy-2-phenylquinoline is COc1cc(OC)c2c(Cl)cc(-c3ccccc3)nc2c1.
What is the InChIKey of 4-chloro-5,7-dimethoxy-2-phenylquinoline?
The InChIKey is BNHUZAMXVXVPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClNO2/c1-20-12-8-15-17(16(9-12)21-2)13(18)10-14(19-15)11-6-4-3-5-7-11/h3-10H,1-2H3.
What are the key properties of 4-chloro-5,7-dimethoxy-2-phenylquinoline?
4-chloro-5,7-dimethoxy-2-phenylquinoline has a molecular weight of 299.76 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5,7-dimethoxy-2-phenylquinoline is sourced from PubChem (CID 43668662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).