N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide

C22H23N3O3 — CID 109232444

IUPACN-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cncc(NCc3cccc(C)c3)c2)cc1OC
InChIInChI=1S/C22H23N3O3/c1-15-5-4-6-16(9-15)12-24-19-10-17(13-23-14-19)22(26)25-18-7-8-20(27-2)21(11-18)28-3/h4-11,13-14,24H,12H2,1-3H3,(H,25,26)
InChIKeyXIMUMSGYAXHSOP-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.27
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide

N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide (PubChem CID 109232444) has the molecular formula C22H23N3O3 and a molecular weight of 377.44 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
PubChem CID109232444
Molecular FormulaC22H23N3O3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC NameN-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cncc(NCc3cccc(C)c3)c2)cc1OC
InChIInChI=1S/C22H23N3O3/c1-15-5-4-6-16(9-15)12-24-19-10-17(13-23-14-19)22(26)25-18-7-8-20(27-2)21(11-18)28-3/h4-11,13-14,24H,12H2,1-3H3,(H,25,26)
InChIKeyXIMUMSGYAXHSOP-UHFFFAOYSA-N
XLogP4.27
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dimethoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
CID 109235722
N-(4-methylphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232401
5-[(3,4-dimethoxyphenyl)methylamino]-N-(3,4-dimethylphenyl)pyridine-3-carboxamide
CID 109237942
N-(4-bromophenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232433
N-(3-chlorophenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232423
3,4-dimethoxy-N-[5-[(3-methylphenyl)methylamino]-2-pyridinyl]benzamide
CID 113026605
N-tert-butyl-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109232386
N-(3,4-dimethoxyphenyl)-5-(prop-2-enylamino)pyridine-3-carboxamide
CID 109224281
5-(benzylamino)-N-[(3-methylphenyl)methyl]pyridine-3-carboxamide
CID 109231789
N-(3-chloro-4-methoxyphenyl)-5-(pyridin-4-ylmethylamino)pyridine-3-carboxamide
CID 109235708
5-(benzylamino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109231885
5-[2-(3,4-dimethoxyphenyl)ethylamino]-N-(4-methylphenyl)pyridine-3-carboxamide
CID 109237774

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide (CID 109232444) is N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide is COc1ccc(NC(=O)c2cncc(NCc3cccc(C)c3)c2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is XIMUMSGYAXHSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O3/c1-15-5-4-6-16(9-15)12-24-19-10-17(13-23-14-19)22(26)25-18-7-8-20(27-2)21(11-18)28-3/h4-11,13-14,24H,12H2,1-3H3,(H,25,26).
What are the key properties of N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide?
N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide has a molecular weight of 377.44 g/mol, XLogP of 4.27, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-5-[(3-methylphenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109232444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).