N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide

C21H19N3O3 — CID 155312844

IUPACN-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc2cccnc2c1
InChIInChI=1S/C21H19N3O3/c25-20(16-7-6-15-4-2-8-22-19(15)14-16)23-18-5-1-3-17(13-18)21(26)24-9-11-27-12-10-24/h1-8,13-14H,9-12H2,(H,23,25)
InChIKeyQMWQXZSUVZWKBY-UHFFFAOYSA-N
MW361.40 g/mol
LogP2.96
Rot. Bonds3

About N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide

N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide (PubChem CID 155312844) has the molecular formula C21H19N3O3 and a molecular weight of 361.40 g/mol. Its IUPAC name is N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide.

Molecular Properties

Compound NameN-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide
PubChem CID155312844
Molecular FormulaC21H19N3O3
Molecular Weight361.40 g/mol
Exact Mass361.14
IUPAC NameN-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc2cccnc2c1
InChIInChI=1S/C21H19N3O3/c25-20(16-7-6-15-4-2-8-22-19(15)14-16)23-18-5-1-3-17(13-18)21(26)24-9-11-27-12-10-24/h1-8,13-14H,9-12H2,(H,23,25)
InChIKeyQMWQXZSUVZWKBY-UHFFFAOYSA-N
XLogP2.96
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[3-(1,4-oxazepane-4-carbonyl)phenyl]quinoline-7-carboxamide;molecular hydrogen
CID 155721911
N-[3-(morpholine-4-carbonyl)phenyl]-4-phenylbenzamide
CID 17205412
3-methoxy-4-methyl-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 55748732
N-(3-acetylphenyl)-4-(morpholine-4-carbonyl)pyridine-2-carboxamide
CID 109082912
N-[3-(morpholine-4-carbonyl)phenyl]-2,3-dihydro-1-benzofuran-5-carboxamide
CID 86996534
4-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 17205497
3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 17205535
3-(quinoline-7-carbonylamino)benzenesulfonic acid
CID 142343655
4-chloro-N-[3-(morpholine-4-carbonyl)phenyl]-3-nitrobenzamide
CID 55797364
N-[3-(morpholine-4-carbonyl)phenyl]-3-propoxybenzamide
CID 17205539
N-(3-acetamidophenyl)-4-(morpholine-4-carbonyl)benzamide
CID 109045524
[3-(hydroxyamino)phenyl]-morpholin-4-ylmethanone
CID 59690262

Frequently Asked Questions

What is the IUPAC name of N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide?
The IUPAC name of N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide (CID 155312844) is N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide.
What is the SMILES notation for N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide?
The canonical SMILES for N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide is O=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1ccc2cccnc2c1.
What is the InChIKey of N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide?
The InChIKey is QMWQXZSUVZWKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O3/c25-20(16-7-6-15-4-2-8-22-19(15)14-16)23-18-5-1-3-17(13-18)21(26)24-9-11-27-12-10-24/h1-8,13-14H,9-12H2,(H,23,25).
What are the key properties of N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide?
N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide has a molecular weight of 361.40 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(morpholine-4-carbonyl)phenyl]quinoline-7-carboxamide is sourced from PubChem (CID 155312844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).