N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide

C20H18ClN3O — CID 109158234

IUPACN-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(NCCc2ccccc2)nc1
InChIInChI=1S/C20H18ClN3O/c21-17-7-4-8-18(13-17)24-20(25)16-9-10-19(23-14-16)22-12-11-15-5-2-1-3-6-15/h1-10,13-14H,11-12H2,(H,22,23)(H,24,25)
InChIKeyPEWDIUHJAOGMOP-UHFFFAOYSA-N
MW351.84 g/mol
LogP4.64
Rot. Bonds6

About N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide

N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide (PubChem CID 109158234) has the molecular formula C20H18ClN3O and a molecular weight of 351.84 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
PubChem CID109158234
Molecular FormulaC20H18ClN3O
Molecular Weight351.84 g/mol
Exact Mass351.11
IUPAC NameN-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1)c1ccc(NCCc2ccccc2)nc1
InChIInChI=1S/C20H18ClN3O/c21-17-7-4-8-18(13-17)24-20(25)16-9-10-19(23-14-16)22-12-11-15-5-2-1-3-6-15/h1-10,13-14H,11-12H2,(H,22,23)(H,24,25)
InChIKeyPEWDIUHJAOGMOP-UHFFFAOYSA-N
XLogP4.64
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.84
LogP ≤ 54.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160796
N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158260
6-[2-(3-chlorophenyl)ethylamino]-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109161942
N-(3-chlorophenyl)-6-[(4-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156937
N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160785
N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160811
N-(3-chlorophenyl)-6-[(2-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156799
6-[2-(4-chlorophenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109158292
N-(3-chlorophenyl)-6-[(4-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155987
N-(1,3-benzodioxol-5-yl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158270
N-(3-methoxyphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160801
N-(3-chloro-2-methylphenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158236

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide (CID 109158234) is N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide is O=C(Nc1cccc(Cl)c1)c1ccc(NCCc2ccccc2)nc1.
What is the InChIKey of N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
The InChIKey is PEWDIUHJAOGMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O/c21-17-7-4-8-18(13-17)24-20(25)16-9-10-19(23-14-16)22-12-11-15-5-2-1-3-6-15/h1-10,13-14H,11-12H2,(H,22,23)(H,24,25).
What are the key properties of N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide has a molecular weight of 351.84 g/mol, XLogP of 4.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109158234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).