1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide

C24H26N2O4 — CID 47062505

IUPAC1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCOCCn1cc(C(=O)NCCc2ccc(OCc3ccccc3)cc2)ccc1=O
InChIInChI=1S/C24H26N2O4/c1-29-16-15-26-17-21(9-12-23(26)27)24(28)25-14-13-19-7-10-22(11-8-19)30-18-20-5-3-2-4-6-20/h2-12,17H,13-16,18H2,1H3,(H,25,28)
InChIKeyHEVKAEONGIIDNH-UHFFFAOYSA-N
MW406.48 g/mol
LogP3.05
Rot. Bonds10

About 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide

1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 47062505) has the molecular formula C24H26N2O4 and a molecular weight of 406.48 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide
PubChem CID47062505
Molecular FormulaC24H26N2O4
Molecular Weight406.48 g/mol
Exact Mass406.19
IUPAC Name1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCOCCn1cc(C(=O)NCCc2ccc(OCc3ccccc3)cc2)ccc1=O
InChIInChI=1S/C24H26N2O4/c1-29-16-15-26-17-21(9-12-23(26)27)24(28)25-14-13-19-7-10-22(11-8-19)30-18-20-5-3-2-4-6-20/h2-12,17H,13-16,18H2,1H3,(H,25,28)
InChIKeyHEVKAEONGIIDNH-UHFFFAOYSA-N
XLogP3.05
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.48
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methoxyethyl)-N-[2-(2-methylphenyl)ethyl]-6-oxopyridine-3-carboxamide
CID 47059590
4-(2-methoxyethoxy)-N-(2-phenylethyl)benzamide
CID 15943281
N-[2-(4-tert-butylphenyl)ethyl]-4-(4-phenylmethoxyphenyl)benzamide
CID 139904878
N-[2-[4-[1-(4-methylpiperazin-1-yl)ethyl]phenyl]ethyl]-4-phenylmethoxybenzamide
CID 23090894
3-(2-methoxyethylsulfamoyl)-N-[2-(4-phenylmethoxyphenyl)ethyl]benzamide
CID 55749716
4-phenylmethoxy-N-propylbenzamide
CID 4958389
4-methoxy-N-[2-(4-methoxyphenyl)ethyl]-3-phenylmethoxybenzamide
CID 102275791
methyl 3-[[4-[6-(4-phenylmethoxyphenoxy)hexyl]benzoyl]amino]propanoate
CID 67485483
1-(2-methoxyethyl)-3-[3-(4-phenylmethoxyphenyl)propyl]urea
CID 110421761
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-1-(2-methoxyethyl)-6-oxopyridine-3-carboxamide
CID 94528338
1-[(2-chlorophenyl)methyl]-6-oxo-N-(2-phenylethyl)pyridine-3-carboxamide
CID 16573910
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(phenoxymethyl)benzamide
CID 26733446

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide (CID 47062505) is 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide is COCCn1cc(C(=O)NCCc2ccc(OCc3ccccc3)cc2)ccc1=O.
What is the InChIKey of 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is HEVKAEONGIIDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4/c1-29-16-15-26-17-21(9-12-23(26)27)24(28)25-14-13-19-7-10-22(11-8-19)30-18-20-5-3-2-4-6-20/h2-12,17H,13-16,18H2,1H3,(H,25,28).
What are the key properties of 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide?
1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 406.48 g/mol, XLogP of 3.05, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 47062505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).