N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide

C23H25N3O2 — CID 113012596

IUPACN-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
SMILESCCN(Cc1ccccc1)c1ccc(NC(=O)Cc2ccc(OC)cc2)cn1
InChIInChI=1S/C23H25N3O2/c1-3-26(17-19-7-5-4-6-8-19)22-14-11-20(16-24-22)25-23(27)15-18-9-12-21(28-2)13-10-18/h4-14,16H,3,15,17H2,1-2H3,(H,25,27)
InChIKeyXQWBXFMNYYQXQD-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.30
Rot. Bonds8

About N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide

N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide (PubChem CID 113012596) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
PubChem CID113012596
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide
SMILESCCN(Cc1ccccc1)c1ccc(NC(=O)Cc2ccc(OC)cc2)cn1
InChIInChI=1S/C23H25N3O2/c1-3-26(17-19-7-5-4-6-8-19)22-14-11-20(16-24-22)25-23(27)15-18-9-12-21(28-2)13-10-18/h4-14,16H,3,15,17H2,1-2H3,(H,25,27)
InChIKeyXQWBXFMNYYQXQD-UHFFFAOYSA-N
XLogP4.30
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 ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113012586
2-amino-N-[6-[benzyl(ethyl)amino]-3-pyridinyl]acetamide
CID 39181885
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-methylpropanamide
CID 113012566
N-[6-(diethylamino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113014581
6-[benzyl(ethyl)amino]-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109157538
1-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3-propan-2-ylurea
CID 113012624
N-[6-(diethylamino)-3-pyridinyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 113014574
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-4-methylbenzamide
CID 113012579
N-[6-[benzyl(propan-2-yl)amino]-3-pyridinyl]-2-phenylacetamide
CID 113015015
6-[ethyl-[(4-methoxyphenyl)methyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133384179
N-(6-bromo-3-pyridinyl)-2-(4-methoxyphenyl)acetamide
CID 110605088
N-benzyl-N-[4-[2-(4-methoxyanilino)-2-oxoethyl]phenyl]propanamide
CID 46045773

Frequently Asked Questions

What is the IUPAC name of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide (CID 113012596) is N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide is CCN(Cc1ccccc1)c1ccc(NC(=O)Cc2ccc(OC)cc2)cn1.
What is the InChIKey of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is XQWBXFMNYYQXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-3-26(17-19-7-5-4-6-8-19)22-14-11-20(16-24-22)25-23(27)15-18-9-12-21(28-2)13-10-18/h4-14,16H,3,15,17H2,1-2H3,(H,25,27).
What are the key properties of N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide?
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 375.47 g/mol, XLogP of 4.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 113012596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).