N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide

C15H24N2O2 — CID 115165723

IUPACN-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
SMILESCCOc1ccc(CNC(=O)C(C)(C)NC)cc1C
InChIInChI=1S/C15H24N2O2/c1-6-19-13-8-7-12(9-11(13)2)10-17-14(18)15(3,4)16-5/h7-9,16H,6,10H2,1-5H3,(H,17,18)
InChIKeyBPPJOCGHYLRQJJ-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.01
Rot. Bonds6

About N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide

N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide (PubChem CID 115165723) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide.

Molecular Properties

Compound NameN-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
PubChem CID115165723
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
SMILESCCOc1ccc(CNC(=O)C(C)(C)NC)cc1C
InChIInChI=1S/C15H24N2O2/c1-6-19-13-8-7-12(9-11(13)2)10-17-14(18)15(3,4)16-5/h7-9,16H,6,10H2,1-5H3,(H,17,18)
InChIKeyBPPJOCGHYLRQJJ-UHFFFAOYSA-N
XLogP2.01
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-methoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide
CID 115165703
3-amino-N-[(4-ethoxy-3-methylphenyl)methyl]-3-methylbutanamide
CID 115154979
N-[(4-ethoxy-3-methylphenyl)methyl]-2-(hydroxymethyl)butanamide
CID 115186556
4-amino-N-[(4-ethoxy-3-methylphenyl)methyl]pentanamide
CID 115156704
N-[(4-ethoxy-3-methylphenyl)methyl]azetidine-3-carboxamide
CID 115158856
N-[(4-ethoxy-3-methylphenyl)methyl]furan-2-carboxamide
CID 110781919
2-methyl-2-(methylamino)-N-[(3-methylphenyl)methyl]propanamide
CID 62847250
1-tert-butyl-3-[2-(4-ethoxy-3-methylphenyl)ethyl]urea
CID 110775842
1-[(4-ethoxy-3-methylphenyl)methyl]-3-(2-hydroxy-3-methylpentyl)urea
CID 111338556
N-[2-(4-ethoxy-3-methylphenyl)ethyl]acetamide
CID 110788838
1-[(4-ethoxy-3-methylphenyl)methyl]-3-(4-hydroxy-2-methylbutyl)urea
CID 111506228
N-[(4-ethoxy-3-methylphenyl)methyl]-3-methoxybenzamide
CID 110781923

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The IUPAC name of N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide (CID 115165723) is N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide.
What is the SMILES notation for N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The canonical SMILES for N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide is CCOc1ccc(CNC(=O)C(C)(C)NC)cc1C.
What is the InChIKey of N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
The InChIKey is BPPJOCGHYLRQJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-6-19-13-8-7-12(9-11(13)2)10-17-14(18)15(3,4)16-5/h7-9,16H,6,10H2,1-5H3,(H,17,18).
What are the key properties of N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide?
N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide has a molecular weight of 264.37 g/mol, XLogP of 2.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxy-3-methylphenyl)methyl]-2-methyl-2-(methylamino)propanamide is sourced from PubChem (CID 115165723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).