2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide

C16H18N2O2 — CID 30307775

IUPAC2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide
SMILESCC(C)(Oc1ccccc1)C(=O)NCc1cccnc1
InChIInChI=1S/C16H18N2O2/c1-16(2,20-14-8-4-3-5-9-14)15(19)18-12-13-7-6-10-17-11-13/h3-11H,12H2,1-2H3,(H,18,19)
InChIKeyKMSKWOZOELZVCN-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.56
Rot. Bonds5

About 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide

2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 30307775) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide
PubChem CID30307775
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC Name2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide
SMILESCC(C)(Oc1ccccc1)C(=O)NCc1cccnc1
InChIInChI=1S/C16H18N2O2/c1-16(2,20-14-8-4-3-5-9-14)15(19)18-12-13-7-6-10-17-11-13/h3-11H,12H2,1-2H3,(H,18,19)
InChIKeyKMSKWOZOELZVCN-UHFFFAOYSA-N
XLogP2.56
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-2-(4-methyl-1-phenylpyrazol-3-yl)oxy-N-(pyridin-3-ylmethyl)propanamide
CID 100829078
2-amino-2-phenyl-N-(pyridin-3-ylmethyl)propanamide
CID 55078393
2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide
CID 60848389
3-amino-3-hydroxyimino-2,2-dimethyl-N-(pyridin-3-ylmethyl)propanamide
CID 76920376
N-butyl-2,2-dimethyl-N'-(pyridin-3-ylmethyl)propanediamide
CID 108957797
N-(2-methoxyphenyl)-2,2-dimethyl-N'-(pyridin-3-ylmethyl)propanediamide
CID 108963576
2-(4-chlorophenoxy)-N-[(4-chlorophenyl)methyl]-2-methylpropanamide
CID 2597715
N-(pyridin-3-ylmethyl)carbamate
CID 19082872
2-phenylmethoxy-N-(pyridin-3-ylmethyl)propanamide
CID 42959352
(2S)-2-(2,2-dimethylpropanoylamino)-4-methyl-N-(pyridin-3-ylmethyl)pentanamide
CID 110351478
3-amino-2-(4-fluorophenyl)-2-methyl-N-(pyridin-3-ylmethyl)propanamide
CID 155040377
2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-N-(pyridin-4-ylmethyl)propanamide
CID 154646142

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide (CID 30307775) is 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide is CC(C)(Oc1ccccc1)C(=O)NCc1cccnc1.
What is the InChIKey of 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is KMSKWOZOELZVCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-16(2,20-14-8-4-3-5-9-14)15(19)18-12-13-7-6-10-17-11-13/h3-11H,12H2,1-2H3,(H,18,19).
What are the key properties of 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 270.33 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 30307775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).