N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide

C23H25N3O2 — CID 109210893

IUPACN-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide
SMILESCOc1cccc(CCNc2ccnc(C(=O)N(C)Cc3ccccc3)c2)c1
InChIInChI=1S/C23H25N3O2/c1-26(17-19-7-4-3-5-8-19)23(27)22-16-20(12-14-25-22)24-13-11-18-9-6-10-21(15-18)28-2/h3-10,12,14-16H,11,13,17H2,1-2H3,(H,24,25)
InChIKeyVEWYJWSZMHPHIM-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.02
Rot. Bonds8

About N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide

N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide (PubChem CID 109210893) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide
PubChem CID109210893
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide
SMILESCOc1cccc(CCNc2ccnc(C(=O)N(C)Cc3ccccc3)c2)c1
InChIInChI=1S/C23H25N3O2/c1-26(17-19-7-4-3-5-8-19)23(27)22-16-20(12-14-25-22)24-13-11-18-9-6-10-21(15-18)28-2/h3-10,12,14-16H,11,13,17H2,1-2H3,(H,24,25)
InChIKeyVEWYJWSZMHPHIM-UHFFFAOYSA-N
XLogP4.02
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 ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-4-[2-(2-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide
CID 109210892
N-benzyl-6-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-3-carboxamide
CID 109156352
4-[2-(4-fluorophenyl)ethylamino]-N-[2-(3-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214178
N-(2-ethylphenyl)-4-[2-(3-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109214474
N-cycloheptyl-4-[2-(3-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109214453
azepan-1-yl-[4-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanone
CID 109214460
N-methyl-N-phenyl-4-(2-phenylethylamino)pyridine-2-carboxamide
CID 109213670
N-benzyl-4-[2-(4-methoxyphenyl)ethylamino]pyridine-2-carboxamide
CID 109209636
4-N-[2-(3-methoxyphenyl)ethyl]-2-N-methyl-2-N-phenylpyridine-2,4-dicarboxamide
CID 109088154
N-butyl-N-methyl-4-(3-phenylpropylamino)pyridine-2-carboxamide
CID 109216678
4-(ethylamino)-N-methyl-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 62168228
4-(3-fluoroanilino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109214435

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide?
The IUPAC name of N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide (CID 109210893) is N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide?
The canonical SMILES for N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide is COc1cccc(CCNc2ccnc(C(=O)N(C)Cc3ccccc3)c2)c1.
What is the InChIKey of N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide?
The InChIKey is VEWYJWSZMHPHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-26(17-19-7-4-3-5-8-19)23(27)22-16-20(12-14-25-22)24-13-11-18-9-6-10-21(15-18)28-2/h3-10,12,14-16H,11,13,17H2,1-2H3,(H,24,25).
What are the key properties of N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide?
N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide has a molecular weight of 375.47 g/mol, XLogP of 4.02, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-[2-(3-methoxyphenyl)ethylamino]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 109210893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).