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

C16H18N2O2 — CID 110724694

IUPACN-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide
SMILESCN(Cc1cccnc1)C(=O)CCOc1ccccc1
InChIInChI=1S/C16H18N2O2/c1-18(13-14-6-5-10-17-12-14)16(19)9-11-20-15-7-3-2-4-8-15/h2-8,10,12H,9,11,13H2,1H3
InChIKeyCQVSBJPUAIEMPC-UHFFFAOYSA-N
MW270.33 g/mol
LogP2.51
Rot. Bonds6

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

N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 110724694) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound NameN-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide
PubChem CID110724694
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide
SMILESCN(Cc1cccnc1)C(=O)CCOc1ccccc1
InChIInChI=1S/C16H18N2O2/c1-18(13-14-6-5-10-17-12-14)16(19)9-11-20-15-7-3-2-4-8-15/h2-8,10,12H,9,11,13H2,1H3
InChIKeyCQVSBJPUAIEMPC-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-4-ylmethyl)propanamide
CID 110724771
N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)acetamide
CID 110724689
4-methoxy-N-methyl-N-(pyridin-3-ylmethyl)butanamide
CID 87010748
N-methyl-5-(3-methylphenoxy)-N-(pyridin-3-ylmethyl)pentanamide
CID 47488024
4-(2-fluorophenoxy)-N-methyl-N-(pyridin-3-ylmethyl)butanamide
CID 86822663
3-(4-aminophenoxy)-N-benzyl-N-methylpropanamide
CID 61089874
N-benzyl-N-methyl-3-[methylsulfonyl(pyridin-3-ylmethyl)amino]propanamide
CID 113139894
2-chloro-N-methyl-N-(pyridin-3-ylmethyl)acetamide
CID 19420340
3-[methyl(3-pyridin-3-yloxypropanoyl)amino]propanoic acid
CID 110837113
N-benzyl-N-methyl-3-(pyridin-3-ylmethylamino)propanamide
CID 109020395
methyl 3-[methyl(pyridin-3-ylmethyl)amino]-3-oxopropanoate
CID 115174424
4-[2-[methyl(pyridin-3-ylmethyl)amino]ethoxy]benzoic acid
CID 43563550

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide (CID 110724694) is N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide is CN(Cc1cccnc1)C(=O)CCOc1ccccc1.
What is the InChIKey of N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is CQVSBJPUAIEMPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-18(13-14-6-5-10-17-12-14)16(19)9-11-20-15-7-3-2-4-8-15/h2-8,10,12H,9,11,13H2,1H3.
What are the key properties of N-methyl-3-phenoxy-N-(pyridin-3-ylmethyl)propanamide?
N-methyl-3-phenoxy-N-(pyridin-3-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-3-ylmethyl)propanamide is sourced from PubChem (CID 110724694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).