N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide

C23H25N3O2 — CID 113028481

IUPACN-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide
SMILESCOc1ccc(CCNc2ccc(NC(=O)CCc3ccccc3)nc2)cc1
InChIInChI=1S/C23H25N3O2/c1-28-21-11-7-19(8-12-21)15-16-24-20-10-13-22(25-17-20)26-23(27)14-9-18-5-3-2-4-6-18/h2-8,10-13,17,24H,9,14-16H2,1H3,(H,25,26,27)
InChIKeyFCMZNFJHXDYBAW-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.32
Rot. Bonds9

About N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide

N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide (PubChem CID 113028481) has the molecular formula C23H25N3O2 and a molecular weight of 375.47 g/mol. Its IUPAC name is N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide
PubChem CID113028481
Molecular FormulaC23H25N3O2
Molecular Weight375.47 g/mol
Exact Mass375.19
IUPAC NameN-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide
SMILESCOc1ccc(CCNc2ccc(NC(=O)CCc3ccccc3)nc2)cc1
InChIInChI=1S/C23H25N3O2/c1-28-21-11-7-19(8-12-21)15-16-24-20-10-13-22(25-17-20)26-23(27)14-9-18-5-3-2-4-6-18/h2-8,10-13,17,24H,9,14-16H2,1H3,(H,25,26,27)
InChIKeyFCMZNFJHXDYBAW-UHFFFAOYSA-N
XLogP4.32
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-phenyl-N-[5-(2-phenylethylamino)-2-pyridinyl]propanamide
CID 113028011
N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-2-phenoxyacetamide
CID 113028482
N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-3-phenoxypropanamide
CID 113013478
N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]-3-phenylpropanamide
CID 113027345
3-fluoro-N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]benzamide
CID 113028470
N-[6-[2-(4-methoxyphenyl)ethylamino]-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 113013483
N-(5-cyano-2-pyridinyl)-3-(4-methoxyphenyl)propanamide
CID 62353143
methyl N-[5-(3-phenylpropylamino)-2-pyridinyl]carbamate
CID 113029848
N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113027011
N-[6-[2-(4-methoxyphenyl)ethylamino]pyridazin-3-yl]-2-phenoxyacetamide
CID 113042788
N-[6-(3-methylbutylamino)-3-pyridinyl]-3-phenylpropanamide
CID 113015098
4-methoxy-N-[4-(2-phenylethylamino)phenyl]benzamide
CID 112983237

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide?
The IUPAC name of N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide (CID 113028481) is N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide.
What is the SMILES notation for N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide?
The canonical SMILES for N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide is COc1ccc(CCNc2ccc(NC(=O)CCc3ccccc3)nc2)cc1.
What is the InChIKey of N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide?
The InChIKey is FCMZNFJHXDYBAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O2/c1-28-21-11-7-19(8-12-21)15-16-24-20-10-13-22(25-17-20)26-23(27)14-9-18-5-3-2-4-6-18/h2-8,10-13,17,24H,9,14-16H2,1H3,(H,25,26,27).
What are the key properties of N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide?
N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide has a molecular weight of 375.47 g/mol, XLogP of 4.32, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(4-methoxyphenyl)ethylamino]-2-pyridinyl]-3-phenylpropanamide is sourced from PubChem (CID 113028481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).