4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide

C23H20N4O — CID 109213726

IUPAC4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1cc(NCCc2ccccc2)ccn1
InChIInChI=1S/C23H20N4O/c28-23(27-20-10-4-8-18-9-5-13-26-22(18)20)21-16-19(12-15-25-21)24-14-11-17-6-2-1-3-7-17/h1-10,12-13,15-16H,11,14H2,(H,24,25)(H,27,28)
InChIKeyXXXFIGJBQZMAED-UHFFFAOYSA-N
MW368.44 g/mol
LogP4.54
Rot. Bonds6

About 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide

4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide (PubChem CID 109213726) has the molecular formula C23H20N4O and a molecular weight of 368.44 g/mol. Its IUPAC name is 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide
PubChem CID109213726
Molecular FormulaC23H20N4O
Molecular Weight368.44 g/mol
Exact Mass368.16
IUPAC Name4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1cc(NCCc2ccccc2)ccn1
InChIInChI=1S/C23H20N4O/c28-23(27-20-10-4-8-18-9-5-13-26-22(18)20)21-16-19(12-15-25-21)24-14-11-17-6-2-1-3-7-17/h1-10,12-13,15-16H,11,14H2,(H,24,25)(H,27,28)
InChIKeyXXXFIGJBQZMAED-UHFFFAOYSA-N
XLogP4.54
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 ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3-methylbutylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109217470
4-(2-phenylethylamino)-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109213682
4-hydrazinyl-N-quinolin-8-ylpyridine-2-carboxamide
CID 62235747
N-(2,5-dimethylphenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213674
N-(2-phenylethyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213524
6-[2-(4-fluorophenyl)ethylamino]-N-quinolin-8-ylpyrimidine-4-carboxamide
CID 109351074
N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213688
4-N-benzyl-2-N-quinolin-8-ylpyridine-2,4-dicarboxamide
CID 109085380
4-(2-phenylethylamino)-N-[3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109213709
4-[2-(4-chlorophenyl)ethylamino]-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109215473
2-(3-phenylpropylamino)-N-quinolin-8-ylpyridine-4-carboxamide
CID 109174892
4-(2-phenylethylamino)-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109213710

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide?
The IUPAC name of 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide (CID 109213726) is 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide.
What is the SMILES notation for 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide?
The canonical SMILES for 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide is O=C(Nc1cccc2cccnc12)c1cc(NCCc2ccccc2)ccn1.
What is the InChIKey of 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide?
The InChIKey is XXXFIGJBQZMAED-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O/c28-23(27-20-10-4-8-18-9-5-13-26-22(18)20)21-16-19(12-15-25-21)24-14-11-17-6-2-1-3-7-17/h1-10,12-13,15-16H,11,14H2,(H,24,25)(H,27,28).
What are the key properties of 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide?
4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide has a molecular weight of 368.44 g/mol, XLogP of 4.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide is sourced from PubChem (CID 109213726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).