4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide

C23H25N3O2 — CID 109211018

IUPAC4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cc(N(C)Cc2ccccc2)ccn1
InChIInChI=1S/C23H25N3O2/c1-26(17-18-8-4-3-5-9-18)20-13-15-24-21(16-20)23(27)25-14-12-19-10-6-7-11-22(19)28-2/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,25,27)
InChIKeyYSZJKXPTGQQDQI-UHFFFAOYSA-N
MW375.47 g/mol
LogP3.70
Rot. Bonds8

About 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide

4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide (PubChem CID 109211018) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
PubChem CID109211018
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC Name4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cc(N(C)Cc2ccccc2)ccn1
InChIInChI=1S/C23H25N3O2/c1-26(17-18-8-4-3-5-9-18)20-13-15-24-21(16-20)23(27)25-14-12-19-10-6-7-11-22(19)28-2/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,25,27)
InChIKeyYSZJKXPTGQQDQI-UHFFFAOYSA-N
XLogP3.70
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]-4-[methyl(2-pyridin-4-ylethyl)amino]pyridine-2-carboxamide
CID 109214259
4-[butyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214268
4-[benzyl(methyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109211014
4-[benzyl(methyl)amino]-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 109205672
4-N-benzyl-2-N-[2-(2-methoxyphenyl)ethyl]pyridine-2,4-dicarboxamide
CID 109085295
4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 106262005
4-N-benzyl-2-N-[(2-methoxyphenyl)methyl]-4-N-methylpyridine-2,4-dicarboxamide
CID 109086172
N-benzyl-4-[2-(2-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide
CID 109210892
N-benzyl-4-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109209634
4-(2-ethylanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214285
4-(4-methoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214302
4-[benzyl(ethyl)amino]-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109212580

Frequently Asked Questions

What is the IUPAC name of 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide (CID 109211018) is 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide is COc1ccccc1CCNC(=O)c1cc(N(C)Cc2ccccc2)ccn1.
What is the InChIKey of 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is YSZJKXPTGQQDQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-26(17-18-8-4-3-5-9-18)20-13-15-24-21(16-20)23(27)25-14-12-19-10-6-7-11-22(19)28-2/h3-11,13,15-16H,12,14,17H2,1-2H3,(H,25,27).
What are the key properties of 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 3.70, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[benzyl(methyl)amino]-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 109211018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).