N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide

C16H24N2O2 — CID 62035767

IUPACN-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide
SMILESCCCN(CC(=O)NC)C(CC)C(=O)c1ccccc1
InChIInChI=1S/C16H24N2O2/c1-4-11-18(12-15(19)17-3)14(5-2)16(20)13-9-7-6-8-10-13/h6-10,14H,4-5,11-12H2,1-3H3,(H,17,19)
InChIKeyMUYCIQXXFZAXKS-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.11
Rot. Bonds8

About N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide

N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide (PubChem CID 62035767) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide
PubChem CID62035767
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide
SMILESCCCN(CC(=O)NC)C(CC)C(=O)c1ccccc1
InChIInChI=1S/C16H24N2O2/c1-4-11-18(12-15(19)17-3)14(5-2)16(20)13-9-7-6-8-10-13/h6-10,14H,4-5,11-12H2,1-3H3,(H,17,19)
InChIKeyMUYCIQXXFZAXKS-UHFFFAOYSA-N
XLogP2.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-1-phenylpropyl)-propylamino]-N-methylacetamide
CID 55017743
2-[ethyl(2,2,2-trifluoroethyl)amino]-1-phenylbutan-1-one
CID 55010357
2-[(2-amino-1-phenylpropyl)-ethylamino]-N-methylacetamide
CID 55017596
2-[1-(3-hydroxyphenyl)ethyl-propylamino]-N-methylacetamide
CID 82985774
2-[1-(4-aminophenyl)ethyl-propylamino]-N-methylacetamide
CID 54984241
2-[ethyl-[1-(2-hydroxyphenyl)ethyl]amino]-N-methylacetamide
CID 82982515
N-(2-benzoylphenyl)-2-[[(1S)-1-phenylethyl]-propylamino]acetamide
CID 102142549
2-[ethyl-(1-oxo-1-phenylpropan-2-yl)amino]acetamide
CID 103103066
N-methyl-2-[[2-(2-methylphenyl)-2-oxoethyl]-propylamino]acetamide
CID 62036541
1-((1,2,3,4,5,6-13C6)cyclohexatrienyl)-2-(methylamino)pentan-1-one
CID 76974159
2-ethyl-1,3-diphenylpropane-1,3-dione
CID 10514968
1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one
CID 43795382

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide?
The IUPAC name of N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide (CID 62035767) is N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide.
What is the SMILES notation for N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide?
The canonical SMILES for N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide is CCCN(CC(=O)NC)C(CC)C(=O)c1ccccc1.
What is the InChIKey of N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide?
The InChIKey is MUYCIQXXFZAXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-11-18(12-15(19)17-3)14(5-2)16(20)13-9-7-6-8-10-13/h6-10,14H,4-5,11-12H2,1-3H3,(H,17,19).
What are the key properties of N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide?
N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.11, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(1-oxo-1-phenylbutan-2-yl)-propylamino]acetamide is sourced from PubChem (CID 62035767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).