N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide

C23H20N4O — CID 109172233

IUPACN-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
SMILESO=C(NCCc1ccccc1)c1ccnc(Nc2cccc3cccnc23)c1
InChIInChI=1S/C23H20N4O/c28-23(26-14-11-17-6-2-1-3-7-17)19-12-15-24-21(16-19)27-20-10-4-8-18-9-5-13-25-22(18)20/h1-10,12-13,15-16H,11,14H2,(H,24,27)(H,26,28)
InChIKeyVUIOBDHOAPWTJW-UHFFFAOYSA-N
MW368.44 g/mol
LogP4.35
Rot. Bonds6

About N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide

N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide (PubChem CID 109172233) has the molecular formula C23H20N4O and a molecular weight of 368.44 g/mol. Its IUPAC name is N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
PubChem CID109172233
Molecular FormulaC23H20N4O
Molecular Weight368.44 g/mol
Exact Mass368.16
IUPAC NameN-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
SMILESO=C(NCCc1ccccc1)c1ccnc(Nc2cccc3cccnc23)c1
InChIInChI=1S/C23H20N4O/c28-23(26-14-11-17-6-2-1-3-7-17)19-12-15-24-21(16-19)27-20-10-4-8-18-9-5-13-25-22(18)20/h1-10,12-13,15-16H,11,14H2,(H,24,27)(H,26,28)
InChIKeyVUIOBDHOAPWTJW-UHFFFAOYSA-N
XLogP4.35
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-bromoanilino)-N-(2-phenylethyl)pyridine-4-carboxamide
CID 109172229
2-(3-phenylpropylamino)-N-quinolin-8-ylpyridine-4-carboxamide
CID 109174892
6-methyl-N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyrimidine-4-carboxamide
CID 109330522
N-[2-(4-fluorophenyl)ethyl]-6-(quinolin-8-ylamino)pyrimidine-4-carboxamide
CID 109351150
2-(2-methylanilino)-N-quinolin-8-ylpyridine-4-carboxamide
CID 109176218
N-(2-phenylethyl)-2-[3-(trifluoromethyl)anilino]pyridine-4-carboxamide
CID 109172217
N-(2-phenylethyl)quinoline-6-carboxamide
CID 2823262
4-N-benzyl-2-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109085380
2-(2-cyanoanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 109172648
N-[2-(4-chlorophenyl)ethyl]-2-(2-cyanoanilino)pyridine-4-carboxamide
CID 109173836
N-(3-chloro-4-methylphenyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide
CID 109177701
2-(2-ethoxyanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 109172626

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide (CID 109172233) is N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide is O=C(NCCc1ccccc1)c1ccnc(Nc2cccc3cccnc23)c1.
What is the InChIKey of N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide?
The InChIKey is VUIOBDHOAPWTJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O/c28-23(26-14-11-17-6-2-1-3-7-17)19-12-15-24-21(16-19)27-20-10-4-8-18-9-5-13-25-22(18)20/h1-10,12-13,15-16H,11,14H2,(H,24,27)(H,26,28).
What are the key properties of N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide?
N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 4.35, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylethyl)-2-(quinolin-8-ylamino)pyridine-4-carboxamide is sourced from PubChem (CID 109172233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).