N-(4-anilino-2-methylbutyl)-N-ethylacetamide

C15H24N2O — CID 10824472

IUPACN-(4-anilino-2-methylbutyl)-N-ethylacetamide
SMILESCCN(CC(C)CCNc1ccccc1)C(C)=O
InChIInChI=1S/C15H24N2O/c1-4-17(14(3)18)12-13(2)10-11-16-15-8-6-5-7-9-15/h5-9,13,16H,4,10-12H2,1-3H3
InChIKeyXCHUFCNQWNROMT-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.99
Rot. Bonds7

About N-(4-anilino-2-methylbutyl)-N-ethylacetamide

N-(4-anilino-2-methylbutyl)-N-ethylacetamide (PubChem CID 10824472) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(4-anilino-2-methylbutyl)-N-ethylacetamide.

Molecular Properties

Compound NameN-(4-anilino-2-methylbutyl)-N-ethylacetamide
PubChem CID10824472
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(4-anilino-2-methylbutyl)-N-ethylacetamide
SMILESCCN(CC(C)CCNc1ccccc1)C(C)=O
InChIInChI=1S/C15H24N2O/c1-4-17(14(3)18)12-13(2)10-11-16-15-8-6-5-7-9-15/h5-9,13,16H,4,10-12H2,1-3H3
InChIKeyXCHUFCNQWNROMT-UHFFFAOYSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 68857725
2-anilinoethyl N-ethyl-N-propylcarbamate
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2-anilino-N,N-diethylacetamide;hydrochloride
CID 119671427
N-(3,4-dimethylpentyl)aniline
CID 89346874
N',N'-diethyl-N-phenyloxamide
CID 14925038
N-ethyl-N-[2-(2-fluorophenyl)-2-(methylamino)ethyl]acetamide
CID 145342139
N-ethyl-4-(ethylamino)-N-(2-methylbutyl)benzamide
CID 79470101
N-(3-methyl-4-trimethoxysilylbutyl)aniline
CID 21024234
(3S)-4-methyl-1-N-phenylpentane-1,3-diamine
CID 71530639
N-(anilinomethyl)-N-methylacetamide
CID 102126839
N,N-diethyl-4-(2-phenylethylamino)benzamide
CID 174426094
2-anilinoethyl 2-methylpropanoate
CID 20975992

Frequently Asked Questions

What is the IUPAC name of N-(4-anilino-2-methylbutyl)-N-ethylacetamide?
The IUPAC name of N-(4-anilino-2-methylbutyl)-N-ethylacetamide (CID 10824472) is N-(4-anilino-2-methylbutyl)-N-ethylacetamide.
What is the SMILES notation for N-(4-anilino-2-methylbutyl)-N-ethylacetamide?
The canonical SMILES for N-(4-anilino-2-methylbutyl)-N-ethylacetamide is CCN(CC(C)CCNc1ccccc1)C(C)=O.
What is the InChIKey of N-(4-anilino-2-methylbutyl)-N-ethylacetamide?
The InChIKey is XCHUFCNQWNROMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-17(14(3)18)12-13(2)10-11-16-15-8-6-5-7-9-15/h5-9,13,16H,4,10-12H2,1-3H3.
What are the key properties of N-(4-anilino-2-methylbutyl)-N-ethylacetamide?
N-(4-anilino-2-methylbutyl)-N-ethylacetamide has a molecular weight of 248.37 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilino-2-methylbutyl)-N-ethylacetamide is sourced from PubChem (CID 10824472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).