3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide

C17H20N2O3 — CID 18167253

IUPAC3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccnc(OC)c2)cc1
InChIInChI=1S/C17H20N2O3/c1-21-15-6-3-13(4-7-15)5-8-16(20)19-12-14-9-10-18-17(11-14)22-2/h3-4,6-7,9-11H,5,8,12H2,1-2H3,(H,19,20)
InChIKeyLJTFGKATISDBLA-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.35
Rot. Bonds7

About 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide

3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide (PubChem CID 18167253) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
PubChem CID18167253
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC Name3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccnc(OC)c2)cc1
InChIInChI=1S/C17H20N2O3/c1-21-15-6-3-13(4-7-15)5-8-16(20)19-12-14-9-10-18-17(11-14)22-2/h3-4,6-7,9-11H,5,8,12H2,1-2H3,(H,19,20)
InChIKeyLJTFGKATISDBLA-UHFFFAOYSA-N
XLogP2.35
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxy-4-pyridinyl)methyl]-3-phenylpropanamide
CID 18167302
2-(4-methoxyphenoxy)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 47019682
3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
CID 898309
3-(2,4-dimethylphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide
CID 18155598
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-yloxyacetamide
CID 18167335
5-chloro-N-[(2-methoxy-4-pyridinyl)methyl]pentanamide
CID 62994356
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide
CID 18167281
N-[[2-(4-methoxyphenoxy)-4-pyridinyl]methyl]hexanamide
CID 87005868
2-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]ethanamine
CID 65445404
N-[(2-methoxy-4-pyridinyl)methyl]-3-(3-methyldiazirin-3-yl)propanamide
CID 172903796
2-(4-formylphenoxy)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
CID 78878322
N-[(4-hydroxyphenyl)methyl]-3-(4-methoxyphenyl)propanamide
CID 115577590

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide (CID 18167253) is 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide is COc1ccc(CCC(=O)NCc2ccnc(OC)c2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
The InChIKey is LJTFGKATISDBLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-21-15-6-3-13(4-7-15)5-8-16(20)19-12-14-9-10-18-17(11-14)22-2/h3-4,6-7,9-11H,5,8,12H2,1-2H3,(H,19,20).
What are the key properties of 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide?
3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide has a molecular weight of 300.36 g/mol, XLogP of 2.35, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-[(2-methoxy-4-pyridinyl)methyl]propanamide is sourced from PubChem (CID 18167253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).