4-(2-chloro-3-ethylquinolin-6-yl)morpholine

C15H17ClN2O — CID 63231613

IUPAC4-(2-chloro-3-ethylquinolin-6-yl)morpholine
SMILESCCc1cc2cc(N3CCOCC3)ccc2nc1Cl
InChIInChI=1S/C15H17ClN2O/c1-2-11-9-12-10-13(18-5-7-19-8-6-18)3-4-14(12)17-15(11)16/h3-4,9-10H,2,5-8H2,1H3
InChIKeyKVWUMSZEPQUTAD-UHFFFAOYSA-N
MW276.77 g/mol
LogP3.29
Rot. Bonds2

About 4-(2-chloro-3-ethylquinolin-6-yl)morpholine

4-(2-chloro-3-ethylquinolin-6-yl)morpholine (PubChem CID 63231613) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is 4-(2-chloro-3-ethylquinolin-6-yl)morpholine.

Molecular Properties

Compound Name4-(2-chloro-3-ethylquinolin-6-yl)morpholine
PubChem CID63231613
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name4-(2-chloro-3-ethylquinolin-6-yl)morpholine
SMILESCCc1cc2cc(N3CCOCC3)ccc2nc1Cl
InChIInChI=1S/C15H17ClN2O/c1-2-11-9-12-10-13(18-5-7-19-8-6-18)3-4-14(12)17-15(11)16/h3-4,9-10H,2,5-8H2,1H3
InChIKeyKVWUMSZEPQUTAD-UHFFFAOYSA-N
XLogP3.29
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

4-[2-chloro-3-(chloromethyl)quinolin-6-yl]morpholine
CID 55176340
4-(4-ethyl-3-methylphenyl)morpholine
CID 71052308
6-morpholin-4-ylquinolin-2-amine
CID 25139674
N-(2-ethyl-5-morpholin-4-ylphenyl)hydroxylamine
CID 163917311
4-(4-ethylphenyl)morpholine
CID 20576442
4-[2,3-bis(4-morpholin-4-ylphenyl)quinoxalin-6-yl]morpholine
CID 168665169
4-(3,4-diethoxyphenyl)morpholine
CID 154477521
(E)-3-(2-chloroquinolin-3-yl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one
CID 40564659
4-[3,5-dimethyl-4-[(2-methyl-4-morpholin-4-ylphenyl)methyl]phenyl]morpholine
CID 135200886
2-ethoxy-6-morpholin-4-ylnaphthalene-1-carbaldehyde
CID 130392111
2,7-dichloro-3-ethylquinoline
CID 39346010
4-(5-ethyl-3-pyridinyl)morpholine
CID 130219562

Frequently Asked Questions

What is the IUPAC name of 4-(2-chloro-3-ethylquinolin-6-yl)morpholine?
The IUPAC name of 4-(2-chloro-3-ethylquinolin-6-yl)morpholine (CID 63231613) is 4-(2-chloro-3-ethylquinolin-6-yl)morpholine.
What is the SMILES notation for 4-(2-chloro-3-ethylquinolin-6-yl)morpholine?
The canonical SMILES for 4-(2-chloro-3-ethylquinolin-6-yl)morpholine is CCc1cc2cc(N3CCOCC3)ccc2nc1Cl.
What is the InChIKey of 4-(2-chloro-3-ethylquinolin-6-yl)morpholine?
The InChIKey is KVWUMSZEPQUTAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-2-11-9-12-10-13(18-5-7-19-8-6-18)3-4-14(12)17-15(11)16/h3-4,9-10H,2,5-8H2,1H3.
What are the key properties of 4-(2-chloro-3-ethylquinolin-6-yl)morpholine?
4-(2-chloro-3-ethylquinolin-6-yl)morpholine has a molecular weight of 276.77 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloro-3-ethylquinolin-6-yl)morpholine is sourced from PubChem (CID 63231613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).