N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide

C15H22N2O2 — CID 62036541

IUPACN-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide
SMILESCCCN(CC(=O)NC)CC(=O)c1ccccc1C
InChIInChI=1S/C15H22N2O2/c1-4-9-17(11-15(19)16-3)10-14(18)13-8-6-5-7-12(13)2/h5-8H,4,9-11H2,1-3H3,(H,16,19)
InChIKeyZTLAXRLTHUHUHF-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.64
Rot. Bonds7

About N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide

N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide (PubChem CID 62036541) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide
PubChem CID62036541
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide
SMILESCCCN(CC(=O)NC)CC(=O)c1ccccc1C
InChIInChI=1S/C15H22N2O2/c1-4-9-17(11-15(19)16-3)10-14(18)13-8-6-5-7-12(13)2/h5-8H,4,9-11H2,1-3H3,(H,16,19)
InChIKeyZTLAXRLTHUHUHF-UHFFFAOYSA-N
XLogP1.64
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2-bromophenyl)-2-oxoethyl]-propylamino]-N-methylacetamide
CID 62035769
2-[cyanomethyl-[2-(2-methylphenyl)-2-oxoethyl]amino]acetonitrile
CID 62051343
2-fluoro-N-[2-(methylamino)-2-oxoethyl]-N-propylbenzamide
CID 61046623
2-(dimethylamino)-1-(2-methylphenyl)ethanone;hydrochloride
CID 178200159
2-[(4-hydroxy-3,5-dimethylphenyl)methyl-propylamino]-N-methylacetamide
CID 82986749
2-(2-carbamothioyl-6-methyl-N-propylanilino)-N-methylacetamide
CID 107108068
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-phenylacetamide
CID 9038815
2-[(2-cyanophenyl)methyl-propylamino]-N-methylacetamide
CID 54978738
N,2-dimethyl-N-propylbenzamide;ethane
CID 142246396
2-(dipropylamino)-1-(2,4,5-trimethylphenyl)ethanone
CID 43219591
N-methyl-2-[[2-oxo-2-[(1-phenylcyclopentyl)methylamino]ethyl]-propylamino]acetamide
CID 87034810
2-[[2-(2-methylanilino)-2-oxoethyl]-propylamino]-N-prop-2-ynylacetamide
CID 8810170

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide?
The IUPAC name of N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide (CID 62036541) is N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide.
What is the SMILES notation for N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide?
The canonical SMILES for N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide is CCCN(CC(=O)NC)CC(=O)c1ccccc1C.
What is the InChIKey of N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide?
The InChIKey is ZTLAXRLTHUHUHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-9-17(11-15(19)16-3)10-14(18)13-8-6-5-7-12(13)2/h5-8H,4,9-11H2,1-3H3,(H,16,19).
What are the key properties of N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide?
N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.64, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide is sourced from PubChem (CID 62036541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).