N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide

C19H20ClN3O — CID 23140704

IUPACN-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)N1CC(N2CCCc3ccccc32)C1
InChIInChI=1S/C19H20ClN3O/c20-15-7-3-8-16(11-15)21-19(24)22-12-17(13-22)23-10-4-6-14-5-1-2-9-18(14)23/h1-3,5,7-9,11,17H,4,6,10,12-13H2,(H,21,24)
InChIKeyJQSHORGLJSWEPB-UHFFFAOYSA-N
MW341.84 g/mol
LogP4.01
Rot. Bonds2

About N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide

N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide (PubChem CID 23140704) has the molecular formula C19H20ClN3O and a molecular weight of 341.84 g/mol. Its IUPAC name is N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide
PubChem CID23140704
Molecular FormulaC19H20ClN3O
Molecular Weight341.84 g/mol
Exact Mass341.13
IUPAC NameN-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)N1CC(N2CCCc3ccccc32)C1
InChIInChI=1S/C19H20ClN3O/c20-15-7-3-8-16(11-15)21-19(24)22-12-17(13-22)23-10-4-6-14-5-1-2-9-18(14)23/h1-3,5,7-9,11,17H,4,6,10,12-13H2,(H,21,24)
InChIKeyJQSHORGLJSWEPB-UHFFFAOYSA-N
XLogP4.01
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.84
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide
CID 23140123
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-methylphenyl)azetidine-1-carboxamide
CID 23139882
methyl 3-[[3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carbonyl]amino]benzoate
CID 23140713
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-fluorophenyl)azetidine-1-carboxamide
CID 23140532
N-(3-chlorophenyl)-3-(triazol-2-yl)pyrrolidine-1-carboxamide
CID 121178780
N-(3-chlorophenyl)-3-hydroxypiperidine-1-carboxamide
CID 17392993
(2R,6R)-N-(3-chlorophenyl)-2,6-dimethylmorpholine-4-carboxamide
CID 41097571
4-(azepan-1-yl)-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 110667169
3-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)azetidine-1-carboxamide
CID 23140046
1-[(3-chlorophenyl)carbamoyl]piperidine-3-carboxylic acid
CID 16777736
3-benzoyl-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 110394499
N-(3-chlorophenyl)-4-methylpiperidine-1-carboxamide
CID 707662

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide (CID 23140704) is N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide is O=C(Nc1cccc(Cl)c1)N1CC(N2CCCc3ccccc32)C1.
What is the InChIKey of N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide?
The InChIKey is JQSHORGLJSWEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O/c20-15-7-3-8-16(11-15)21-19(24)22-12-17(13-22)23-10-4-6-14-5-1-2-9-18(14)23/h1-3,5,7-9,11,17H,4,6,10,12-13H2,(H,21,24).
What are the key properties of N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide?
N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide has a molecular weight of 341.84 g/mol, XLogP of 4.01, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-3-(3,4-dihydro-2H-quinolin-1-yl)azetidine-1-carboxamide is sourced from PubChem (CID 23140704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).