4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide

C22H24N2O3 — CID 92867755

IUPAC4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide
SMILESCCOc1cc(-c2ccc(C)cc2)nc2ccc(C(=O)NC[C@@H](C)O)cc12
InChIInChI=1S/C22H24N2O3/c1-4-27-21-12-20(16-7-5-14(2)6-8-16)24-19-10-9-17(11-18(19)21)22(26)23-13-15(3)25/h5-12,15,25H,4,13H2,1-3H3,(H,23,26)/t15-/m1/s1
InChIKeyNCZNAXXDWDETKQ-OAHLLOKOSA-N
MW364.45 g/mol
LogP3.72
Rot. Bonds6

About 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide

4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide (PubChem CID 92867755) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide.

Molecular Properties

Compound Name4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide
PubChem CID92867755
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide
SMILESCCOc1cc(-c2ccc(C)cc2)nc2ccc(C(=O)NC[C@@H](C)O)cc12
InChIInChI=1S/C22H24N2O3/c1-4-27-21-12-20(16-7-5-14(2)6-8-16)24-19-10-9-17(11-18(19)21)22(26)23-13-15(3)25/h5-12,15,25H,4,13H2,1-3H3,(H,23,26)/t15-/m1/s1
InChIKeyNCZNAXXDWDETKQ-OAHLLOKOSA-N
XLogP3.72
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethoxy-N-(4-methylphenyl)-2-phenylquinoline-6-carboxamide
CID 46318814
4-ethoxy-N-(2-hydroxyphenyl)-2-(4-methylphenyl)quinoline-6-carboxamide
CID 46319059
4-ethoxy-2-(4-methylphenyl)-N-(3,4,5-trimethoxyphenyl)quinoline-6-carboxamide
CID 46319060
4-methoxy-2-(4-methylphenyl)-N-propylquinoline-6-carboxamide
CID 46319104
4-methoxy-N-(2-methoxyethyl)-2-(4-methylphenyl)quinoline-6-carboxamide
CID 46319106
ethyl 4-ethoxy-2-phenylquinoline-6-carboxylate
CID 22425101
methyl 4-ethoxy-2-(4-fluorophenyl)quinoline-6-carboxylate
CID 154854437
4-ethoxy-2-(4-fluorophenyl)-N-(2-hydroxyphenyl)quinoline-6-carboxamide
CID 46319037
4-ethoxy-N-(2-hydroxypropyl)-3-methoxybenzamide
CID 43391198
4-ethoxy-N-(2-methoxy-5-methylphenyl)-2-(3-methoxyphenyl)quinoline-6-carboxamide
CID 46318892
4-ethoxy-2-(4-methylphenyl)-N-[3-(1H-1,2,4-triazol-5-yl)propyl]quinoline-7-carboxamide
CID 134164673
4-methoxy-N-[(3-methoxyphenyl)methyl]-2-(4-methylphenyl)quinoline-6-carboxamide
CID 46319113

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide?
The IUPAC name of 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide (CID 92867755) is 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide.
What is the SMILES notation for 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide?
The canonical SMILES for 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide is CCOc1cc(-c2ccc(C)cc2)nc2ccc(C(=O)NC[C@@H](C)O)cc12.
What is the InChIKey of 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide?
The InChIKey is NCZNAXXDWDETKQ-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-4-27-21-12-20(16-7-5-14(2)6-8-16)24-19-10-9-17(11-18(19)21)22(26)23-13-15(3)25/h5-12,15,25H,4,13H2,1-3H3,(H,23,26)/t15-/m1/s1.
What are the key properties of 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide?
4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.72, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[(2R)-2-hydroxypropyl]-2-(4-methylphenyl)quinoline-6-carboxamide is sourced from PubChem (CID 92867755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).