N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide

C15H24N2O2 — CID 11850181

IUPACN-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide
SMILESCCCCNC(=O)C(c1ccc(C)cc1)N(C)OC
InChIInChI=1S/C15H24N2O2/c1-5-6-11-16-15(18)14(17(3)19-4)13-9-7-12(2)8-10-13/h7-10,14H,5-6,11H2,1-4H3,(H,16,18)
InChIKeyFSEBMKXSQJLYRB-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.45
Rot. Bonds7

About N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide

N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide (PubChem CID 11850181) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide
PubChem CID11850181
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide
SMILESCCCCNC(=O)C(c1ccc(C)cc1)N(C)OC
InChIInChI=1S/C15H24N2O2/c1-5-6-11-16-15(18)14(17(3)19-4)13-9-7-12(2)8-10-13/h7-10,14H,5-6,11H2,1-4H3,(H,16,18)
InChIKeyFSEBMKXSQJLYRB-UHFFFAOYSA-N
XLogP2.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(dimethylamino)-N-(3-hydroxypropyl)-2-(4-methylphenyl)acetamide
CID 72902135
4-[[(2R)-2-(dimethylamino)-2-(4-methylphenyl)acetyl]amino]butanoic acid
CID 97269726
tert-butyl N-[4-amino-1-[[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]-methylamino]-1,4-dioxobutan-2-yl]carbamate
CID 18049345
tert-butyl N-[1-[tert-butyl-[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]amino]-1-oxopropan-2-yl]carbamate
CID 18012580
tert-butyl N-[2-[[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]-prop-2-enylamino]-2-oxoethyl]carbamate
CID 18016285
tert-butyl N-[1-[[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]-pentylamino]-1-oxopropan-2-yl]carbamate
CID 18013435
tert-butyl N-[1-[tert-butyl-[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]amino]-3-hydroxy-1-oxopropan-2-yl]carbamate
CID 18035380
tert-butyl N-[2-[butan-2-yl-[1-(4-methylphenyl)-2-oxo-2-(pentylamino)ethyl]amino]-2-oxoethyl]carbamate
CID 18018852
tert-butyl N-[1-[[1-(4-methylphenyl)-2-oxo-2-(pentylamino)ethyl]-propan-2-ylamino]-1-oxopropan-2-yl]carbamate
CID 18011727
tert-butyl N-[1-[[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]-hexylamino]-3-methyl-1-oxobutan-2-yl]carbamate
CID 18042505
3-butyl-1-methoxy-1-(4-methylphenyl)sulfonylurea
CID 18368785
tert-butyl N-[1-[[2-(butylamino)-1-(4-methylphenyl)-2-oxoethyl]-(2-hydroxyethyl)amino]-1-oxo-3-sulfanylpropan-2-yl]carbamate
CID 18056755

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide?
The IUPAC name of N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide (CID 11850181) is N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide is CCCCNC(=O)C(c1ccc(C)cc1)N(C)OC.
What is the InChIKey of N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide?
The InChIKey is FSEBMKXSQJLYRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-6-11-16-15(18)14(17(3)19-4)13-9-7-12(2)8-10-13/h7-10,14H,5-6,11H2,1-4H3,(H,16,18).
What are the key properties of N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide?
N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide has a molecular weight of 264.37 g/mol, XLogP of 2.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-[methoxy(methyl)amino]-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 11850181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).