N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide

C23H23N3O3 — CID 109236828

IUPACN-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide
SMILESCOc1cccc(CCNc2cncc(C(=O)Nc3cccc(C(C)=O)c3)c2)c1
InChIInChI=1S/C23H23N3O3/c1-16(27)18-6-4-7-20(12-18)26-23(28)19-13-21(15-24-14-19)25-10-9-17-5-3-8-22(11-17)29-2/h3-8,11-15,25H,9-10H2,1-2H3,(H,26,28)
InChIKeyNPYNATYVODTISG-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.20
Rot. Bonds8

About N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide

N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide (PubChem CID 109236828) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide
PubChem CID109236828
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC NameN-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide
SMILESCOc1cccc(CCNc2cncc(C(=O)Nc3cccc(C(C)=O)c3)c2)c1
InChIInChI=1S/C23H23N3O3/c1-16(27)18-6-4-7-20(12-18)26-23(28)19-13-21(15-24-14-19)25-10-9-17-5-3-8-22(11-17)29-2/h3-8,11-15,25H,9-10H2,1-2H3,(H,26,28)
InChIKeyNPYNATYVODTISG-UHFFFAOYSA-N
XLogP4.20
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chlorophenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236816
5-[2-(3-methoxyphenyl)ethylamino]-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235779
N-(2,4-dimethylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236799
5-[2-(3-methoxyphenyl)ethylamino]-N-(3-methoxypropyl)pyridine-3-carboxamide
CID 109228038
N-(3-fluorophenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236961
5-(3-acetylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109245209
N-(4-acetylphenyl)-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109236959
5-(benzylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109231885
5-[2-(3-chlorophenyl)ethylamino]-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109241188
N-[2-(3-methoxyphenyl)ethyl]-5-(pentylamino)pyridine-3-carboxamide
CID 109236721
N-[2-(3-methoxyphenyl)ethyl]-5-(3-methylbutylamino)pyridine-3-carboxamide
CID 109236720
N-[2-(3-methoxyphenyl)ethyl]-5-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
CID 109235637

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide (CID 109236828) is N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide is COc1cccc(CCNc2cncc(C(=O)Nc3cccc(C(C)=O)c3)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The InChIKey is NPYNATYVODTISG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-16(27)18-6-4-7-20(12-18)26-23(28)19-13-21(15-24-14-19)25-10-9-17-5-3-8-22(11-17)29-2/h3-8,11-15,25H,9-10H2,1-2H3,(H,26,28).
What are the key properties of N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 4.20, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-5-[2-(3-methoxyphenyl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109236828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).