2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide

C16H24N2O — CID 60561239

IUPAC2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C16H24N2O/c1-16(2,3)12-5-9-14(10-6-12)18(4)11-15(19)17-13-7-8-13/h5-6,9-10,13H,7-8,11H2,1-4H3,(H,17,19)
InChIKeyWEXJDKSCHQAKAQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.70
Rot. Bonds4

About 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide

2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide (PubChem CID 60561239) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide
PubChem CID60561239
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide
SMILESCN(CC(=O)NC1CC1)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C16H24N2O/c1-16(2,3)12-5-9-14(10-6-12)18(4)11-15(19)17-13-7-8-13/h5-6,9-10,13H,7-8,11H2,1-4H3,(H,17,19)
InChIKeyWEXJDKSCHQAKAQ-UHFFFAOYSA-N
XLogP2.70
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-tert-butyl-N-methylanilino)-N-methylacetamide
CID 60562398
2-(4-tert-butylanilino)-N-cyclopropylacetamide
CID 28571999
N-cyclopropyl-2-(4-formyl-N,3-dimethylanilino)acetamide
CID 62135938
N'-(4-tert-butylphenyl)-N-cyclopropylpropanediamide
CID 108941074
3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide
CID 60631425
2-[4-(aminomethyl)-3-fluoro-N-methylanilino]-N-cyclopropylacetamide
CID 113295386
N-cyclopropyl-2-[4-[(cyclopropylamino)methyl]-N,3-dimethylanilino]acetamide
CID 62129290
2-[(4-tert-butylphenyl)methylsulfanyl]-N-cyclopropylacetamide
CID 134017051
2-[1-(4-tert-butylphenyl)ethylamino]-N-cyclopropylacetamide
CID 43568343
4-tert-butyl-N-[2-[(4-hydroxycyclohexyl)amino]-2-oxoethyl]benzamide
CID 110877644
1-(4-tert-butylphenyl)-3-cyclopropylurea
CID 47127423
2-(5-amino-N,2-dimethylanilino)-N-cyclopropylacetamide
CID 62588683

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide?
The IUPAC name of 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide (CID 60561239) is 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide.
What is the SMILES notation for 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide?
The canonical SMILES for 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide is CN(CC(=O)NC1CC1)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide?
The InChIKey is WEXJDKSCHQAKAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-16(2,3)12-5-9-14(10-6-12)18(4)11-15(19)17-13-7-8-13/h5-6,9-10,13H,7-8,11H2,1-4H3,(H,17,19).
What are the key properties of 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide?
2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide has a molecular weight of 260.38 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butyl-N-methylanilino)-N-cyclopropylacetamide is sourced from PubChem (CID 60561239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).