3-chloro-8-cyclopropyloxy-6-methylquinoline

C13H12ClNO — CID 156872367

IUPAC3-chloro-8-cyclopropyloxy-6-methylquinoline
SMILESCc1cc(OC2CC2)c2ncc(Cl)cc2c1
InChIInChI=1S/C13H12ClNO/c1-8-4-9-6-10(14)7-15-13(9)12(5-8)16-11-2-3-11/h4-7,11H,2-3H2,1H3
InChIKeyJGYTYYRCUGVWFT-UHFFFAOYSA-N
MW233.70 g/mol
LogP3.74
Rot. Bonds2

About 3-chloro-8-cyclopropyloxy-6-methylquinoline

3-chloro-8-cyclopropyloxy-6-methylquinoline (PubChem CID 156872367) has the molecular formula C13H12ClNO and a molecular weight of 233.70 g/mol. Its IUPAC name is 3-chloro-8-cyclopropyloxy-6-methylquinoline.

Molecular Properties

Compound Name3-chloro-8-cyclopropyloxy-6-methylquinoline
PubChem CID156872367
Molecular FormulaC13H12ClNO
Molecular Weight233.70 g/mol
Exact Mass233.06
IUPAC Name3-chloro-8-cyclopropyloxy-6-methylquinoline
SMILESCc1cc(OC2CC2)c2ncc(Cl)cc2c1
InChIInChI=1S/C13H12ClNO/c1-8-4-9-6-10(14)7-15-13(9)12(5-8)16-11-2-3-11/h4-7,11H,2-3H2,1H3
InChIKeyJGYTYYRCUGVWFT-UHFFFAOYSA-N
XLogP3.74
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.70
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Chloroacetoxyquinoline
CID 2718
5-Chloro-8-phenoxyquinoline
CID 2767025
8-Methoxyquinoline
CID 70310
8-Ethoxyquinoline
CID 73781
5-Chloro-8-[(3-Chlorobenzyl)oxy]quinoline
CID 56643075
4-Chloro-6-methoxyquinoline
CID 228348
2-Chloro-8-methoxyquinoline
CID 3585267
3-(3,3-Dichloroprop-2-enyl)-4-chloro-8-methoxy-2-methylquinoline
CID 790401
4-Chloro-3-ethyl-8-methoxy-2-methylquinoline
CID 790790
8-[3-(2-Chlorophenoxy)propoxy]quinoline
CID 2283001
4-Chloro-8-methoxy-2-methyl-3-prop-2-enylquinoline
CID 684228
4-Chloro-3-(2-chloroethyl)-8-methoxy-2-methylquinoline
CID 3332664

Frequently Asked Questions

What is the IUPAC name of 3-chloro-8-cyclopropyloxy-6-methylquinoline?
The IUPAC name of 3-chloro-8-cyclopropyloxy-6-methylquinoline (CID 156872367) is 3-chloro-8-cyclopropyloxy-6-methylquinoline.
What is the SMILES notation for 3-chloro-8-cyclopropyloxy-6-methylquinoline?
The canonical SMILES for 3-chloro-8-cyclopropyloxy-6-methylquinoline is Cc1cc(OC2CC2)c2ncc(Cl)cc2c1.
What is the InChIKey of 3-chloro-8-cyclopropyloxy-6-methylquinoline?
The InChIKey is JGYTYYRCUGVWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12ClNO/c1-8-4-9-6-10(14)7-15-13(9)12(5-8)16-11-2-3-11/h4-7,11H,2-3H2,1H3.
What are the key properties of 3-chloro-8-cyclopropyloxy-6-methylquinoline?
3-chloro-8-cyclopropyloxy-6-methylquinoline has a molecular weight of 233.70 g/mol, XLogP of 3.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-8-cyclopropyloxy-6-methylquinoline is sourced from PubChem (CID 156872367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).