3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide

C16H18N2O2 — CID 898315

IUPAC3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccccn2)cc1
InChIInChI=1S/C16H18N2O2/c1-20-15-8-5-13(6-9-15)7-10-16(19)18-12-14-4-2-3-11-17-14/h2-6,8-9,11H,7,10,12H2,1H3,(H,18,19)
InChIKeyHKJLSRRCKSTWTL-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.34
Rot. Bonds6

About 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide

3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 898315) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
PubChem CID898315
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
SMILESCOc1ccc(CCC(=O)NCc2ccccn2)cc1
InChIInChI=1S/C16H18N2O2/c1-20-15-8-5-13(6-9-15)7-10-16(19)18-12-14-4-2-3-11-17-14/h2-6,8-9,11H,7,10,12H2,1H3,(H,18,19)
InChIKeyHKJLSRRCKSTWTL-UHFFFAOYSA-N
XLogP2.34
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide
CID 31100473
3-(4-methoxyphenyl)-N-[(1-methyl-5-pyridin-2-ylpyrazol-3-yl)methyl]propanamide
CID 90555638
3-(4-methoxyphenyl)-N-[(4-methoxyphenyl)methyl]propanamide
CID 898309
3-[3-[(4-methoxyphenyl)methyl]-4-oxopyrido[2,3-d]pyrimidin-2-yl]-N-(pyridin-2-ylmethyl)propanamide
CID 23602540
(3S)-3-(4-methoxyphenyl)-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 26404777
3-(4-methoxyphenyl)-N-(1,3-oxazol-4-ylmethyl)propanamide
CID 110718948
1-N-[2-(4-methoxyphenyl)ethyl]-3-N-(pyridin-2-ylmethyl)benzene-1,3-dicarboxamide
CID 109054965
4-(3,4-dimethoxyphenyl)-N-(pyridin-2-ylmethyl)butanamide
CID 110410541
3-(4-methoxyphenyl)-N-[(6-methylpyridazin-3-yl)methyl]propanamide
CID 110737936
2-[2-(4-methoxyphenoxy)ethylamino]-N-(pyridin-2-ylmethyl)acetamide
CID 108999224
1-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-(pyridin-2-ylmethyl)guanidine
CID 110969434
N-[[2-(hydroxymethyl)phenyl]methyl]-3-(4-methoxyphenyl)propanamide
CID 110902384

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide (CID 898315) is 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide is COc1ccc(CCC(=O)NCc2ccccn2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is HKJLSRRCKSTWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-20-15-8-5-13(6-9-15)7-10-16(19)18-12-14-4-2-3-11-17-14/h2-6,8-9,11H,7,10,12H2,1H3,(H,18,19).
What are the key properties of 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide?
3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 270.33 g/mol, XLogP of 2.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 898315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).