N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide

C16H18N2O2 — CID 110724771

IUPACN-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide
SMILESCN(Cc1ccncc1)C(=O)CCOc1ccccc1
InChIInChI=1S/C16H18N2O2/c1-18(13-14-7-10-17-11-8-14)16(19)9-12-20-15-5-3-2-4-6-15/h2-8,10-11H,9,12-13H2,1H3
InChIKeyOYMNAQXDGLORRX-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.51
Rot. Bonds6

About N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide

N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide (PubChem CID 110724771) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide.

Molecular Properties

Compound NameN-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide
PubChem CID110724771
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide
SMILESCN(Cc1ccncc1)C(=O)CCOc1ccccc1
InChIInChI=1S/C16H18N2O2/c1-18(13-14-7-10-17-11-8-14)16(19)9-12-20-15-5-3-2-4-6-15/h2-8,10-11H,9,12-13H2,1H3
InChIKeyOYMNAQXDGLORRX-UHFFFAOYSA-N
XLogP2.51
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide
CID 110724694
3-(3-aminophenoxy)-N-methyl-N-(pyridin-4-ylmethyl)propanamide
CID 61095622
N-methyl-3-phenoxy-N-[[4-(trifluoromethyl)phenyl]methyl]propanamide
CID 112791829
N-methyl-N-(3-phenoxypropyl)-3-pyridin-4-ylpropanamide
CID 60508904
3-(4-aminophenoxy)-N-benzyl-N-methylpropanamide
CID 61089874
N-[(4-fluorophenyl)methyl]-N-methyl-4-phenoxybutanamide
CID 78770382
N-[2-[methyl(2-pyridin-4-ylethyl)amino]-2-oxoethyl]-3-phenoxypropanamide
CID 112993704
N-[2-[acetyl(pyridin-4-ylmethyl)amino]ethyl]-3-phenoxypropanamide
CID 113055446
3-(2-fluorophenyl)-N-methyl-N-(pyridin-4-ylmethyl)propanamide
CID 110724799
1-methyl-1-(3-phenoxypropyl)-3-(pyridin-4-ylmethyl)urea
CID 86998973
N-[(3-fluorophenyl)methyl]-N-methyl-4-phenoxybutanamide
CID 86975850
N-methyl-4-phenoxy-N-(quinolin-3-ylmethyl)butanamide
CID 110745516

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide?
The IUPAC name of N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide (CID 110724771) is N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide.
What is the SMILES notation for N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide?
The canonical SMILES for N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide is CN(Cc1ccncc1)C(=O)CCOc1ccccc1.
What is the InChIKey of N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide?
The InChIKey is OYMNAQXDGLORRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18(13-14-7-10-17-11-8-14)16(19)9-12-20-15-5-3-2-4-6-15/h2-8,10-11H,9,12-13H2,1H3.
What are the key properties of N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide?
N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide has a molecular weight of 270.33 g/mol, XLogP of 2.51, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-phenoxy-N-(pyridin-4-ylmethyl)propanamide is sourced from PubChem (CID 110724771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).