N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide

C22H23N3O4 — CID 157014793

IUPACN-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
SMILESCOc1ncccc1CCNC(=O)c1c(OCc2ccccc2)c(=O)ccn1C
InChIInChI=1S/C22H23N3O4/c1-25-14-11-18(26)20(29-15-16-7-4-3-5-8-16)19(25)21(27)23-13-10-17-9-6-12-24-22(17)28-2/h3-9,11-12,14H,10,13,15H2,1-2H3,(H,23,27)
InChIKeyIOSSVLDMSSCZHR-UHFFFAOYSA-N
MW393.44 g/mol
LogP2.34
Rot. Bonds8

About N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide

N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide (PubChem CID 157014793) has the molecular formula C22H23N3O4 and a molecular weight of 393.44 g/mol. Its IUPAC name is N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
PubChem CID157014793
Molecular FormulaC22H23N3O4
Molecular Weight393.44 g/mol
Exact Mass393.17
IUPAC NameN-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
SMILESCOc1ncccc1CCNC(=O)c1c(OCc2ccccc2)c(=O)ccn1C
InChIInChI=1S/C22H23N3O4/c1-25-14-11-18(26)20(29-15-16-7-4-3-5-8-16)19(25)21(27)23-13-10-17-9-6-12-24-22(17)28-2/h3-9,11-12,14H,10,13,15H2,1-2H3,(H,23,27)
InChIKeyIOSSVLDMSSCZHR-UHFFFAOYSA-N
XLogP2.34
TPSA82.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide with MolForge

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Related Compounds

N-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
CID 156585394
1-(2-hydroxyethyl)-4-oxo-3-phenylmethoxy-N-propylpyridine-2-carboxamide
CID 143761971
1-amino-N-(4,4-dimethoxybutyl)-4-oxo-3-phenylmethoxypyridine-2-carboxamide
CID 70369313
N-[2-(2-methoxy-3-pyridinyl)ethyl]-5-methyl-4-oxo-6,7-dihydropyrazolo[1,5-a]pyrazine-2-carboxamide
CID 146040508
4-[2-(2-methoxy-3-pyridinyl)ethylcarbamoylamino]butanoic acid
CID 122014854
N-[2-[(2-methoxy-3-pyridinyl)methylamino]-2-oxoethyl]-2-phenylacetamide
CID 37486176
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide
CID 156586518
1-[(3-fluorophenyl)methyl]-N-[2-(2-methoxy-3-pyridinyl)ethyl]indole-3-carboxamide
CID 166984636
1-methyl-N-[2-[2-[(1-methyl-2-oxo-3-phenylmethoxypyridine-4-carbonyl)amino]ethoxy]ethyl]-2-oxo-3-phenylmethoxypyridine-4-carboxamide
CID 10054072
1-[2-(2-methoxy-3-pyridinyl)ethylcarbamoyl]piperidine-4-carboxylic acid
CID 122014852
2-[2-[(2-methoxy-3-pyridinyl)methoxy]phenyl]acetic acid
CID 80741526
1-methyl-3-phenylmethoxy-2-[4-(1H-pyrazol-5-yl)piperidine-1-carbonyl]pyridin-4-one
CID 162632752

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
The IUPAC name of N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide (CID 157014793) is N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide.
What is the SMILES notation for N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
The canonical SMILES for N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide is COc1ncccc1CCNC(=O)c1c(OCc2ccccc2)c(=O)ccn1C.
What is the InChIKey of N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
The InChIKey is IOSSVLDMSSCZHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4/c1-25-14-11-18(26)20(29-15-16-7-4-3-5-8-16)19(25)21(27)23-13-10-17-9-6-12-24-22(17)28-2/h3-9,11-12,14H,10,13,15H2,1-2H3,(H,23,27).
What are the key properties of N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide?
N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide has a molecular weight of 393.44 g/mol, XLogP of 2.34, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxy-3-pyridinyl)ethyl]-1-methyl-4-oxo-3-phenylmethoxypyridine-2-carboxamide is sourced from PubChem (CID 157014793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).