N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide

C16H24N2O2 — CID 112995384

IUPACN-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
SMILESCCCCN(C)C(=O)CNC(=O)Cc1cccc(C)c1
InChIInChI=1S/C16H24N2O2/c1-4-5-9-18(3)16(20)12-17-15(19)11-14-8-6-7-13(2)10-14/h6-8,10H,4-5,9,11-12H2,1-3H3,(H,17,19)
InChIKeyZPFUWNVXMNUFAP-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.91
Rot. Bonds7

About N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide

N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide (PubChem CID 112995384) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
PubChem CID112995384
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
SMILESCCCCN(C)C(=O)CNC(=O)Cc1cccc(C)c1
InChIInChI=1S/C16H24N2O2/c1-4-5-9-18(3)16(20)12-17-15(19)11-14-8-6-7-13(2)10-14/h6-8,10H,4-5,9,11-12H2,1-3H3,(H,17,19)
InChIKeyZPFUWNVXMNUFAP-UHFFFAOYSA-N
XLogP1.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[benzyl(ethyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 112992909
N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-thiophen-2-ylacetamide
CID 112995358
N-methyl-N-[2-(3-methylphenyl)ethyl]pentanamide
CID 23577992
2-(ethylamino)-N-methyl-N-[2-(3-methylphenyl)ethyl]acetamide
CID 115158122
N-(5-chloropentyl)-N-methyl-2-(3-methylphenyl)acetamide
CID 107205663
N-[3-(diethylamino)propyl]-2-(3-methylphenyl)acetamide
CID 127120142
N-[2-[butyl(methyl)amino]-2-oxoethyl]-3-chlorobenzamide
CID 78800713
N-[2-(diethylamino)ethyl]-2-(3-methylphenyl)acetamide
CID 17144542
N-[2-[5-hydroxypentyl(methyl)amino]-2-oxoethyl]-3-methylbenzamide
CID 107202831
4-[methyl-[2-[(3-methylbenzoyl)amino]acetyl]amino]butanoic acid
CID 43359941
N-butyl-N-methyl-3-(3-methylanilino)propanamide
CID 109032339
N-[2-(4-ethylanilino)-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 112996808

Frequently Asked Questions

What is the IUPAC name of N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide (CID 112995384) is N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide is CCCCN(C)C(=O)CNC(=O)Cc1cccc(C)c1.
What is the InChIKey of N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
The InChIKey is ZPFUWNVXMNUFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-5-9-18(3)16(20)12-17-15(19)11-14-8-6-7-13(2)10-14/h6-8,10H,4-5,9,11-12H2,1-3H3,(H,17,19).
What are the key properties of N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 1.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butyl(methyl)amino]-2-oxoethyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 112995384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).