N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide

C20H18ClN3O — CID 109213688

IUPACN-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc(NCCc2ccccc2)ccn1
InChIInChI=1S/C20H18ClN3O/c21-16-6-8-17(9-7-16)24-20(25)19-14-18(11-13-23-19)22-12-10-15-4-2-1-3-5-15/h1-9,11,13-14H,10,12H2,(H,22,23)(H,24,25)
InChIKeyUSPSXONZBIKAJH-UHFFFAOYSA-N
MW351.84 g/mol
LogP4.64
Rot. Bonds6

About N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide

N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide (PubChem CID 109213688) has the molecular formula C20H18ClN3O and a molecular weight of 351.84 g/mol. Its IUPAC name is N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
PubChem CID109213688
Molecular FormulaC20H18ClN3O
Molecular Weight351.84 g/mol
Exact Mass351.11
IUPAC NameN-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cc(NCCc2ccccc2)ccn1
InChIInChI=1S/C20H18ClN3O/c21-16-6-8-17(9-7-16)24-20(25)19-14-18(11-13-23-19)22-12-10-15-4-2-1-3-5-15/h1-9,11,13-14H,10,12H2,(H,22,23)(H,24,25)
InChIKeyUSPSXONZBIKAJH-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

4-(2-phenylethylamino)-N-[4-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109213710
4-[2-(3-chlorophenyl)ethylamino]-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109218509
N-(2-phenylethyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213524
4-[2-(4-chlorophenyl)ethylamino]-N-(2-methylphenyl)pyridine-2-carboxamide
CID 109215473
4-[(4-chlorophenyl)methylamino]-N-phenylpyridine-2-carboxamide
CID 109211886
N-(4-chlorophenyl)-4-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109214357
N-(4-chlorophenyl)-2-(2-phenylethylamino)pyrimidine-4-carboxamide
CID 109307802
4-(2-phenylethylamino)-N-[3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
CID 109213709
N-(1,3-benzodioxol-5-yl)-4-[2-(4-chlorophenyl)ethylamino]pyridine-2-carboxamide
CID 109215494
N-(2,5-dimethylphenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213674
N-(4-chlorophenyl)-4-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109207365
4-(2-phenylethylamino)-N-(2-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109213682

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide (CID 109213688) is N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide is O=C(Nc1ccc(Cl)cc1)c1cc(NCCc2ccccc2)ccn1.
What is the InChIKey of N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide?
The InChIKey is USPSXONZBIKAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O/c21-16-6-8-17(9-7-16)24-20(25)19-14-18(11-13-23-19)22-12-10-15-4-2-1-3-5-15/h1-9,11,13-14H,10,12H2,(H,22,23)(H,24,25).
What are the key properties of N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide?
N-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-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-(4-chlorophenyl)-4-(2-phenylethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 109213688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).