N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide

C15H24N2O2 — CID 116501066

IUPACN-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide
SMILESCCC(=O)Nc1cccc(NCC(C)COC)c1C
InChIInChI=1S/C15H24N2O2/c1-5-15(18)17-14-8-6-7-13(12(14)3)16-9-11(2)10-19-4/h6-8,11,16H,5,9-10H2,1-4H3,(H,17,18)
InChIKeyRURHYYUCDKLTKZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP3.04
Rot. Bonds7

About N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide

N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide (PubChem CID 116501066) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide.

Molecular Properties

Compound NameN-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide
PubChem CID116501066
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide
SMILESCCC(=O)Nc1cccc(NCC(C)COC)c1C
InChIInChI=1S/C15H24N2O2/c1-5-15(18)17-14-8-6-7-13(12(14)3)16-9-11(2)10-19-4/h6-8,11,16H,5,9-10H2,1-4H3,(H,17,18)
InChIKeyRURHYYUCDKLTKZ-UHFFFAOYSA-N
XLogP3.04
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 ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(3-methoxybutan-2-ylamino)-2-methylphenyl]propanamide
CID 115916566
N-[2-methyl-3-[[2-[(2-methylpropan-2-yl)oxy]acetyl]amino]phenyl]propanamide
CID 115949978
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300469
methyl N-[(2S)-4-methyl-1-[2-methyl-3-(propanoylamino)anilino]-1-oxopentan-2-yl]carbamate
CID 94797775
2-(4-methylphenoxy)-N-[2-methyl-3-(propanoylamino)phenyl]propanamide
CID 46760564
N-[3-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 38773209
N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
CID 38300689
5-[(3-methoxy-2-methylpropyl)amino]naphthalen-1-ol
CID 116501113
N-[3-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 38773224
N-[2-methyl-3-[[2-[3-(2-methylpropoxy)anilino]acetyl]amino]phenyl]propanamide
CID 54823522
N-[2-methyl-3-[[2-(3-propan-2-yloxyanilino)acetyl]amino]phenyl]propanamide
CID 54830253

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide?
The IUPAC name of N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide (CID 116501066) is N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide.
What is the SMILES notation for N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide?
The canonical SMILES for N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide is CCC(=O)Nc1cccc(NCC(C)COC)c1C.
What is the InChIKey of N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide?
The InChIKey is RURHYYUCDKLTKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-15(18)17-14-8-6-7-13(12(14)3)16-9-11(2)10-19-4/h6-8,11,16H,5,9-10H2,1-4H3,(H,17,18).
What are the key properties of N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide?
N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide has a molecular weight of 264.37 g/mol, XLogP of 3.04, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-methoxy-2-methylpropyl)amino]-2-methylphenyl]propanamide is sourced from PubChem (CID 116501066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).