4-chloro-2-ethyl-8-propoxyquinoline

C14H16ClNO — CID 43668471

IUPAC4-chloro-2-ethyl-8-propoxyquinoline
SMILESCCCOc1cccc2c(Cl)cc(CC)nc12
InChIInChI=1S/C14H16ClNO/c1-3-8-17-13-7-5-6-11-12(15)9-10(4-2)16-14(11)13/h5-7,9H,3-4,8H2,1-2H3
InChIKeyIKHPNJLCSDMBCD-UHFFFAOYSA-N
MW249.74 g/mol
LogP4.24
Rot. Bonds4

About 4-chloro-2-ethyl-8-propoxyquinoline

4-chloro-2-ethyl-8-propoxyquinoline (PubChem CID 43668471) has the molecular formula C14H16ClNO and a molecular weight of 249.74 g/mol. Its IUPAC name is 4-chloro-2-ethyl-8-propoxyquinoline.

Molecular Properties

Compound Name4-chloro-2-ethyl-8-propoxyquinoline
PubChem CID43668471
Molecular FormulaC14H16ClNO
Molecular Weight249.74 g/mol
Exact Mass249.09
IUPAC Name4-chloro-2-ethyl-8-propoxyquinoline
SMILESCCCOc1cccc2c(Cl)cc(CC)nc12
InChIInChI=1S/C14H16ClNO/c1-3-8-17-13-7-5-6-11-12(15)9-10(4-2)16-14(11)13/h5-7,9H,3-4,8H2,1-2H3
InChIKeyIKHPNJLCSDMBCD-UHFFFAOYSA-N
XLogP4.24
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.74
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-chloro-2-ethyl-8-propoxyquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-ethyl-8-propoxyquinolin-4-amine
CID 62203401
N,2-diethyl-8-propoxyquinolin-4-amine
CID 63481576
4-chloro-2-ethyl-3-methyl-8-propoxyquinoline
CID 55221893
2-(methoxymethyl)-8-propoxyquinolin-4-amine
CID 62318793
4-chloro-2-ethyl-6,8-dimethoxyquinoline
CID 43668808
2-propan-2-yl-8-propoxyquinolin-4-amine
CID 62203402
4-chloro-2-(methoxymethyl)-8-(2,2,2-trifluoroethoxy)quinoline
CID 62319927
4-chloro-3-iodo-8-propoxyquinoline
CID 102614030
2-tert-butyl-N-ethyl-8-propoxyquinolin-4-amine
CID 63481575
methyl 4-chloro-8-ethoxyquinoline-2-carboxylate
CID 63376560
N,N'-bis(4-propoxyacridin-9-yl)butane-1,4-diamine
CID 21198496
2,4-dichloro-1-propoxynaphthalene
CID 70099872

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethyl-8-propoxyquinoline?
The IUPAC name of 4-chloro-2-ethyl-8-propoxyquinoline (CID 43668471) is 4-chloro-2-ethyl-8-propoxyquinoline.
What is the SMILES notation for 4-chloro-2-ethyl-8-propoxyquinoline?
The canonical SMILES for 4-chloro-2-ethyl-8-propoxyquinoline is CCCOc1cccc2c(Cl)cc(CC)nc12.
What is the InChIKey of 4-chloro-2-ethyl-8-propoxyquinoline?
The InChIKey is IKHPNJLCSDMBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO/c1-3-8-17-13-7-5-6-11-12(15)9-10(4-2)16-14(11)13/h5-7,9H,3-4,8H2,1-2H3.
What are the key properties of 4-chloro-2-ethyl-8-propoxyquinoline?
4-chloro-2-ethyl-8-propoxyquinoline has a molecular weight of 249.74 g/mol, XLogP of 4.24, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethyl-8-propoxyquinoline is sourced from PubChem (CID 43668471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).