4-chloro-7-(2-phenylethoxy)quinoline

C17H14ClNO — CID 78324294

IUPAC4-chloro-7-(2-phenylethoxy)quinoline
SMILESClc1ccnc2cc(OCCc3ccccc3)ccc12
InChIInChI=1S/C17H14ClNO/c18-16-8-10-19-17-12-14(6-7-15(16)17)20-11-9-13-4-2-1-3-5-13/h1-8,10,12H,9,11H2
InChIKeyHHLDNXJXVCRMMR-UHFFFAOYSA-N
MW283.76 g/mol
LogP4.51
Rot. Bonds4

About 4-chloro-7-(2-phenylethoxy)quinoline

4-chloro-7-(2-phenylethoxy)quinoline (PubChem CID 78324294) has the molecular formula C17H14ClNO and a molecular weight of 283.76 g/mol. Its IUPAC name is 4-chloro-7-(2-phenylethoxy)quinoline.

Molecular Properties

Compound Name4-chloro-7-(2-phenylethoxy)quinoline
PubChem CID78324294
Molecular FormulaC17H14ClNO
Molecular Weight283.76 g/mol
Exact Mass283.08
IUPAC Name4-chloro-7-(2-phenylethoxy)quinoline
SMILESClc1ccnc2cc(OCCc3ccccc3)ccc12
InChIInChI=1S/C17H14ClNO/c18-16-8-10-19-17-12-14(6-7-15(16)17)20-11-9-13-4-2-1-3-5-13/h1-8,10,12H,9,11H2
InChIKeyHHLDNXJXVCRMMR-UHFFFAOYSA-N
XLogP4.51
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-7-(2-methoxyethoxy)quinoline
CID 22265262
4-chloro-7-hexoxyquinoline
CID 78323998
4-chloro-6-phenylmethoxyquinoline
CID 23078431
2-(4-chloroquinolin-7-yl)oxyethyl-methylcarbamic acid
CID 174166475
4-chloro-7-(1-phenylethoxy)quinoline
CID 141359583
3-chloro-2,6-bis(2-phenylethoxy)naphthalene
CID 121473068
4-chloro-7-[(4-chloroquinolin-7-yl)methoxymethyl]quinoline
CID 22054612
2-[2-(4-chloroquinolin-7-yl)oxyethylamino]ethyl-methylcarbamic acid
CID 174166411
7-(2-bromoethyl)-4-chloroquinoline
CID 174461037
4,7-dichloroquinoline
CID 6866
4-chloro-6-phenoxyquinoline
CID 43531961
6-(2-phenylethoxy)chromen-4-one
CID 57379747

Frequently Asked Questions

What is the IUPAC name of 4-chloro-7-(2-phenylethoxy)quinoline?
The IUPAC name of 4-chloro-7-(2-phenylethoxy)quinoline (CID 78324294) is 4-chloro-7-(2-phenylethoxy)quinoline.
What is the SMILES notation for 4-chloro-7-(2-phenylethoxy)quinoline?
The canonical SMILES for 4-chloro-7-(2-phenylethoxy)quinoline is Clc1ccnc2cc(OCCc3ccccc3)ccc12.
What is the InChIKey of 4-chloro-7-(2-phenylethoxy)quinoline?
The InChIKey is HHLDNXJXVCRMMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClNO/c18-16-8-10-19-17-12-14(6-7-15(16)17)20-11-9-13-4-2-1-3-5-13/h1-8,10,12H,9,11H2.
What are the key properties of 4-chloro-7-(2-phenylethoxy)quinoline?
4-chloro-7-(2-phenylethoxy)quinoline has a molecular weight of 283.76 g/mol, XLogP of 4.51, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-7-(2-phenylethoxy)quinoline is sourced from PubChem (CID 78324294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).