2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide

C15H24N2O2 — CID 119742882

IUPAC2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide
SMILESCNCC(C)C(=O)Nc1ccc(COC(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)19-10-13-5-7-14(8-6-13)17-15(18)12(3)9-16-4/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18)
InChIKeyLWROVCHORFDZGK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.41
Rot. Bonds7

About 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide

2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide (PubChem CID 119742882) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide
PubChem CID119742882
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide
SMILESCNCC(C)C(=O)Nc1ccc(COC(C)C)cc1
InChIInChI=1S/C15H24N2O2/c1-11(2)19-10-13-5-7-14(8-6-13)17-15(18)12(3)9-16-4/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18)
InChIKeyLWROVCHORFDZGK-UHFFFAOYSA-N
XLogP2.41
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(2-methylpropanoylamino)phenyl]-4-(propan-2-yloxymethyl)benzamide
CID 30865071
2-methyl-3-(methylamino)-N-[4-(methylsulfanylmethyl)phenyl]propanamide;hydrochloride
CID 119769549
2-methyl-3-(methylamino)-N-[4-(methylcarbamoylamino)phenyl]propanamide
CID 79195690
4-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]butanamide
CID 119742858
[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] 4-(propan-2-yloxymethyl)benzoate
CID 8985418
N-[4-(carbamoylamino)phenyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119701452
N-(4-iodophenyl)-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119672677
(2S)-2-amino-4-methylsulfanyl-N-[4-(propan-2-yloxymethyl)phenyl]butanamide
CID 119300044
[(2R)-1-(4-fluoroanilino)-1-oxopropan-2-yl] 4-(propan-2-yloxymethyl)benzoate
CID 8985937
[(2S)-1-(4-bromoanilino)-1-oxopropan-2-yl] 4-(propan-2-yloxymethyl)benzoate
CID 8985722
2-methyl-3-(methylamino)-N-[3-(2-propan-2-yloxyethoxymethyl)phenyl]propanamide
CID 119754179
[(2R)-1-(4-ethoxyanilino)-1-oxopropan-2-yl] 4-(propan-2-yloxymethyl)benzoate
CID 9382760

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide?
The IUPAC name of 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide (CID 119742882) is 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide.
What is the SMILES notation for 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide?
The canonical SMILES for 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide is CNCC(C)C(=O)Nc1ccc(COC(C)C)cc1.
What is the InChIKey of 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide?
The InChIKey is LWROVCHORFDZGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)19-10-13-5-7-14(8-6-13)17-15(18)12(3)9-16-4/h5-8,11-12,16H,9-10H2,1-4H3,(H,17,18).
What are the key properties of 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide?
2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide has a molecular weight of 264.37 g/mol, XLogP of 2.41, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-N-[4-(propan-2-yloxymethyl)phenyl]propanamide is sourced from PubChem (CID 119742882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).