N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide

C23H25N3O2 — CID 109158769

IUPACN-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
SMILESCOc1ccccc1CCNc1ccc(C(=O)Nc2cccc(C)c2C)cn1
InChIInChI=1S/C23H25N3O2/c1-16-7-6-9-20(17(16)2)26-23(27)19-11-12-22(25-15-19)24-14-13-18-8-4-5-10-21(18)28-3/h4-12,15H,13-14H2,1-3H3,(H,24,25)(H,26,27)
InChIKeyKMQACQQIDZQZFF-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.61
Rot. Bonds7

About N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide

N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide (PubChem CID 109158769) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
PubChem CID109158769
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
SMILESCOc1ccccc1CCNc1ccc(C(=O)Nc2cccc(C)c2C)cn1
InChIInChI=1S/C23H25N3O2/c1-16-7-6-9-20(17(16)2)26-23(27)19-11-12-22(25-15-19)24-14-13-18-8-4-5-10-21(18)28-3/h4-12,15H,13-14H2,1-3H3,(H,24,25)(H,26,27)
InChIKeyKMQACQQIDZQZFF-UHFFFAOYSA-N
XLogP4.61
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide (CID 109158769) is N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide is COc1ccccc1CCNc1ccc(C(=O)Nc2cccc(C)c2C)cn1.
What is the InChIKey of N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
The InChIKey is KMQACQQIDZQZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-16-7-6-9-20(17(16)2)26-23(27)19-11-12-22(25-15-19)24-14-13-18-8-4-5-10-21(18)28-3/h4-12,15H,13-14H2,1-3H3,(H,24,25)(H,26,27).
What are the key properties of N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide?
N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.61, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109158769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).