N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide

C20H18ClN3O — CID 109156138

IUPACN-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
SMILESCC(Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccccc1
InChIInChI=1S/C20H18ClN3O/c1-14(15-6-3-2-4-7-15)23-19-11-10-16(13-22-19)20(25)24-18-9-5-8-17(21)12-18/h2-14H,1H3,(H,22,23)(H,24,25)
InChIKeyUCARFSRYCURJCT-UHFFFAOYSA-N
MW351.84 g/mol
LogP5.16
Rot. Bonds5

About N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide

N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide (PubChem CID 109156138) has the molecular formula C20H18ClN3O and a molecular weight of 351.84 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
PubChem CID109156138
Molecular FormulaC20H18ClN3O
Molecular Weight351.84 g/mol
Exact Mass351.11
IUPAC NameN-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
SMILESCC(Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccccc1
InChIInChI=1S/C20H18ClN3O/c1-14(15-6-3-2-4-7-15)23-19-11-10-16(13-22-19)20(25)24-18-9-5-8-17(21)12-18/h2-14H,1H3,(H,22,23)(H,24,25)
InChIKeyUCARFSRYCURJCT-UHFFFAOYSA-N
XLogP5.16
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.84
LogP ≤ 55.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109156139
N-(3-chloro-4-fluorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109156144
N-(3-chlorophenyl)-6-[1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethylamino]pyridine-3-carboxamide
CID 133334649
4-fluoro-N-[6-(1-phenylethylamino)-3-pyridinyl]benzamide
CID 113011864
N-(2-bromophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide
CID 109156169
6-(4-acetylanilino)-N-(3-chlorophenyl)pyridine-3-carboxamide
CID 109163447
N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158234
6-(3,5-dichloroanilino)-N-phenylpyridine-3-carboxamide
CID 109162127
N-(3-chlorophenyl)-6-methyl-2-(1-phenylethylamino)pyrimidine-4-carboxamide
CID 109328055
N-(3-chlorophenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160796
N-(3-chlorophenyl)-4-propan-2-ylbenzamide
CID 1406456
N-(3-chlorophenyl)-6-[(2-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156799

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide (CID 109156138) is N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide is CC(Nc1ccc(C(=O)Nc2cccc(Cl)c2)cn1)c1ccccc1.
What is the InChIKey of N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
The InChIKey is UCARFSRYCURJCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O/c1-14(15-6-3-2-4-7-15)23-19-11-10-16(13-22-19)20(25)24-18-9-5-8-17(21)12-18/h2-14H,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide?
N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide has a molecular weight of 351.84 g/mol, XLogP of 5.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-(1-phenylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109156138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).