4,8-bis(phenylmethoxy)quinoline-2-carboxamide

C24H20N2O3 — CID 71567698

IUPAC4,8-bis(phenylmethoxy)quinoline-2-carboxamide
SMILESNC(=O)c1cc(OCc2ccccc2)c2cccc(OCc3ccccc3)c2n1
InChIInChI=1S/C24H20N2O3/c25-24(27)20-14-22(29-16-18-10-5-2-6-11-18)19-12-7-13-21(23(19)26-20)28-15-17-8-3-1-4-9-17/h1-14H,15-16H2,(H2,25,27)
InChIKeyZEJHUXFLOPKLQL-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.49
Rot. Bonds7

About 4,8-bis(phenylmethoxy)quinoline-2-carboxamide

4,8-bis(phenylmethoxy)quinoline-2-carboxamide (PubChem CID 71567698) has the molecular formula C24H20N2O3 and a molecular weight of 384.44 g/mol. Its IUPAC name is 4,8-bis(phenylmethoxy)quinoline-2-carboxamide.

Molecular Properties

Compound Name4,8-bis(phenylmethoxy)quinoline-2-carboxamide
PubChem CID71567698
Molecular FormulaC24H20N2O3
Molecular Weight384.44 g/mol
Exact Mass384.15
IUPAC Name4,8-bis(phenylmethoxy)quinoline-2-carboxamide
SMILESNC(=O)c1cc(OCc2ccccc2)c2cccc(OCc3ccccc3)c2n1
InChIInChI=1S/C24H20N2O3/c25-24(27)20-14-22(29-16-18-10-5-2-6-11-18)19-12-7-13-21(23(19)26-20)28-15-17-8-3-1-4-9-17/h1-14H,15-16H2,(H2,25,27)
InChIKeyZEJHUXFLOPKLQL-UHFFFAOYSA-N
XLogP4.49
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-bis(phenylmethoxy)pyridine-2,6-dicarboxylic acid
CID 54512111
phenyl-(4-phenylmethoxyquinolin-2-yl)methanone
CID 21478950
methyl 8-(N,2-dimethylanilino)-4-phenylmethoxyquinoline-2-carboxylate
CID 157317010
5-amino-6-phenylmethoxypyridine-2-carboxamide
CID 114408377
7-(2,2-dimethoxyethyl)-8-phenylmethoxyquinoline-2-carboxamide
CID 174927088
6-[(5-chloro-2-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide;hydrochloride
CID 140535401
4-(3-methylhex-1-ynyl)-8-phenylmethoxyquinoline-2-carboxylic acid
CID 150222270
(4-phenylmethoxyquinolin-2-yl)methanamine
CID 63377220
3-(4-oxo-8-phenylmethoxy-3H-quinazolin-2-yl)propanoic acid
CID 177042268
ethyl 4-phenylmethoxynaphthalene-2-carboxylate
CID 22127020
2-[(3-phenylmethoxyphenyl)methoxy]benzamide
CID 60603891
4-benzyl-3-ethynyl-8-phenylmethoxyquinoline-2-carboxylic acid
CID 87938064

Frequently Asked Questions

What is the IUPAC name of 4,8-bis(phenylmethoxy)quinoline-2-carboxamide?
The IUPAC name of 4,8-bis(phenylmethoxy)quinoline-2-carboxamide (CID 71567698) is 4,8-bis(phenylmethoxy)quinoline-2-carboxamide.
What is the SMILES notation for 4,8-bis(phenylmethoxy)quinoline-2-carboxamide?
The canonical SMILES for 4,8-bis(phenylmethoxy)quinoline-2-carboxamide is NC(=O)c1cc(OCc2ccccc2)c2cccc(OCc3ccccc3)c2n1.
What is the InChIKey of 4,8-bis(phenylmethoxy)quinoline-2-carboxamide?
The InChIKey is ZEJHUXFLOPKLQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2O3/c25-24(27)20-14-22(29-16-18-10-5-2-6-11-18)19-12-7-13-21(23(19)26-20)28-15-17-8-3-1-4-9-17/h1-14H,15-16H2,(H2,25,27).
What are the key properties of 4,8-bis(phenylmethoxy)quinoline-2-carboxamide?
4,8-bis(phenylmethoxy)quinoline-2-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8-bis(phenylmethoxy)quinoline-2-carboxamide is sourced from PubChem (CID 71567698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).