2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide

C24H27N3O3 — CID 1220212

IUPAC2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide
SMILESCOc1ccc(-c2nc3ccccc3c(C(=O)NCCN3CCOCC3)c2C)cc1
InChIInChI=1S/C24H27N3O3/c1-17-22(24(28)25-11-12-27-13-15-30-16-14-27)20-5-3-4-6-21(20)26-23(17)18-7-9-19(29-2)10-8-18/h3-10H,11-16H2,1-2H3,(H,25,28)
InChIKeyREVBZCPNOKUSQA-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.28
Rot. Bonds6

About 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide

2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide (PubChem CID 1220212) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide
PubChem CID1220212
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide
SMILESCOc1ccc(-c2nc3ccccc3c(C(=O)NCCN3CCOCC3)c2C)cc1
InChIInChI=1S/C24H27N3O3/c1-17-22(24(28)25-11-12-27-13-15-30-16-14-27)20-5-3-4-6-21(20)26-23(17)18-7-9-19(29-2)10-8-18/h3-10H,11-16H2,1-2H3,(H,25,28)
InChIKeyREVBZCPNOKUSQA-UHFFFAOYSA-N
XLogP3.28
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-2-(4-methylphenyl)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide
CID 5008423
2-(4-methoxyphenyl)-3-methyl-N-(2-phenylethyl)quinoline-4-carboxamide
CID 5197457
2-(4-methoxyphenyl)-3-(2-morpholin-4-ylethylamino)quinazolin-4-one
CID 131748521
2-(4-methoxyphenyl)-3-methyl-N-propan-2-ylquinoline-4-carboxamide
CID 896971
5-(4-methoxyphenyl)-2-methyl-N-(2-morpholin-4-ylethyl)-1-phenylpyrrole-3-carboxamide
CID 42785508
N-(2,6-diethylphenyl)-2-(4-methoxyphenyl)-3-methylquinoline-4-carboxamide
CID 3681950
2-(4-chlorophenyl)-N-[2-[[2-(4-chlorophenyl)-3-methylquinoline-4-carbonyl]amino]ethyl]-3-methylquinoline-4-carboxamide
CID 4160455
2-(4-chlorophenyl)-3-methyl-N-morpholin-4-ylquinoline-4-carboxamide
CID 4638984
3-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)-4-oxophthalazine-1-carboxamide
CID 4053675
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-yloxyphenyl)quinoline-4-carboxamide
CID 3442010
2-(4-methoxyanilino)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide
CID 24793582
2-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 20963131

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide?
The IUPAC name of 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide (CID 1220212) is 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide?
The canonical SMILES for 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide is COc1ccc(-c2nc3ccccc3c(C(=O)NCCN3CCOCC3)c2C)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide?
The InChIKey is REVBZCPNOKUSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c1-17-22(24(28)25-11-12-27-13-15-30-16-14-27)20-5-3-4-6-21(20)26-23(17)18-7-9-19(29-2)10-8-18/h3-10H,11-16H2,1-2H3,(H,25,28).
What are the key properties of 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide?
2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide has a molecular weight of 405.50 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)quinoline-4-carboxamide is sourced from PubChem (CID 1220212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).