4-chloro-2-(phenoxymethyl)quinoline

C16H12ClNO — CID 134835185

IUPAC4-chloro-2-(phenoxymethyl)quinoline
SMILESClc1cc(COc2ccccc2)nc2ccccc12
InChIInChI=1S/C16H12ClNO/c17-15-10-12(11-19-13-6-2-1-3-7-13)18-16-9-5-4-8-14(15)16/h1-10H,11H2
InChIKeyDPHGUDRUOXYRSG-UHFFFAOYSA-N
MW269.73 g/mol
LogP4.47
Rot. Bonds3

About 4-chloro-2-(phenoxymethyl)quinoline

4-chloro-2-(phenoxymethyl)quinoline (PubChem CID 134835185) has the molecular formula C16H12ClNO and a molecular weight of 269.73 g/mol. Its IUPAC name is 4-chloro-2-(phenoxymethyl)quinoline.

Molecular Properties

Compound Name4-chloro-2-(phenoxymethyl)quinoline
PubChem CID134835185
Molecular FormulaC16H12ClNO
Molecular Weight269.73 g/mol
Exact Mass269.06
IUPAC Name4-chloro-2-(phenoxymethyl)quinoline
SMILESClc1cc(COc2ccccc2)nc2ccccc12
InChIInChI=1S/C16H12ClNO/c17-15-10-12(11-19-13-6-2-1-3-7-13)18-16-9-5-4-8-14(15)16/h1-10H,11H2
InChIKeyDPHGUDRUOXYRSG-UHFFFAOYSA-N
XLogP4.47
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.73
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-2-decylquinoline
CID 171487257
4-chloro-2-[2-(3-chlorophenyl)ethyl]quinoline
CID 23614355
3,5-dichloro-4-(quinolin-2-ylmethoxy)aniline
CID 43351628
3-(4-chloroquinolin-2-yl)-1-phenylpropan-1-one
CID 132941648
2,3,7,8-tetrakis(phenoxymethyl)phenazine
CID 15048480
3-(4-chloroquinolin-2-yl)-2-[(4-chloroquinolin-2-yl)methyl]-1-phenylpropan-1-one
CID 132915470
methyl 4-[(4-chloroquinolin-2-yl)methyl]benzoate
CID 10543090
2-chloro-5-(quinolin-2-ylmethoxy)benzoic acid
CID 110168584
2-[(4-chloro-3-fluorophenoxy)methyl]quinoline
CID 82727045
4-chloro-2-(trifluoromethyl)quinoline
CID 2736709
4-chloro-2-pyridin-2-ylquinoline
CID 24903559
[4-(3,4-dichlorophenoxy)quinolin-2-yl]methanamine
CID 63377726

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(phenoxymethyl)quinoline?
The IUPAC name of 4-chloro-2-(phenoxymethyl)quinoline (CID 134835185) is 4-chloro-2-(phenoxymethyl)quinoline.
What is the SMILES notation for 4-chloro-2-(phenoxymethyl)quinoline?
The canonical SMILES for 4-chloro-2-(phenoxymethyl)quinoline is Clc1cc(COc2ccccc2)nc2ccccc12.
What is the InChIKey of 4-chloro-2-(phenoxymethyl)quinoline?
The InChIKey is DPHGUDRUOXYRSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12ClNO/c17-15-10-12(11-19-13-6-2-1-3-7-13)18-16-9-5-4-8-14(15)16/h1-10H,11H2.
What are the key properties of 4-chloro-2-(phenoxymethyl)quinoline?
4-chloro-2-(phenoxymethyl)quinoline has a molecular weight of 269.73 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(phenoxymethyl)quinoline is sourced from PubChem (CID 134835185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).