2-(4-methylanilino)-2-propylpentanamide

C15H24N2O — CID 54889215

IUPAC2-(4-methylanilino)-2-propylpentanamide
SMILESCCCC(CCC)(Nc1ccc(C)cc1)C(N)=O
InChIInChI=1S/C15H24N2O/c1-4-10-15(11-5-2,14(16)18)17-13-8-6-12(3)7-9-13/h6-9,17H,4-5,10-11H2,1-3H3,(H2,16,18)
InChIKeyQXHOACCAOROZCS-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.23
Rot. Bonds7

About 2-(4-methylanilino)-2-propylpentanamide

2-(4-methylanilino)-2-propylpentanamide (PubChem CID 54889215) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(4-methylanilino)-2-propylpentanamide.

Molecular Properties

Compound Name2-(4-methylanilino)-2-propylpentanamide
PubChem CID54889215
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(4-methylanilino)-2-propylpentanamide
SMILESCCCC(CCC)(Nc1ccc(C)cc1)C(N)=O
InChIInChI=1S/C15H24N2O/c1-4-10-15(11-5-2,14(16)18)17-13-8-6-12(3)7-9-13/h6-9,17H,4-5,10-11H2,1-3H3,(H2,16,18)
InChIKeyQXHOACCAOROZCS-UHFFFAOYSA-N
XLogP3.23
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-methyl-2-(4-methylanilino)pentanoate
CID 54889848
methyl 2-ethyl-2-(4-methylanilino)butanoate
CID 54889628
2-anilino-2-(4-methylphenyl)butanamide
CID 60996158
ethyl 2-(4-methoxyanilino)-2-propylpentanoate
CID 60991340
methyl 2-(4-chloroanilino)-2-ethylpentanoate
CID 114079648
ethyl 2-(3-methylanilino)-2-propylpentanoate
CID 63525337
2-(4-methoxyanilino)-2-methylpentanamide
CID 54889125
methanamine;N-(4-methylphenyl)acetamide
CID 142152295
2-anilino-2-methylpentanoic acid
CID 60992039
2-ethyl-2-(3-methoxyanilino)hexanamide
CID 63953655
methyl 2-(3-fluoro-5-methylanilino)-2-propylpentanoate
CID 79049647
2-anilino-2-decyltridecanoic acid
CID 139977207

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylanilino)-2-propylpentanamide?
The IUPAC name of 2-(4-methylanilino)-2-propylpentanamide (CID 54889215) is 2-(4-methylanilino)-2-propylpentanamide.
What is the SMILES notation for 2-(4-methylanilino)-2-propylpentanamide?
The canonical SMILES for 2-(4-methylanilino)-2-propylpentanamide is CCCC(CCC)(Nc1ccc(C)cc1)C(N)=O.
What is the InChIKey of 2-(4-methylanilino)-2-propylpentanamide?
The InChIKey is QXHOACCAOROZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-10-15(11-5-2,14(16)18)17-13-8-6-12(3)7-9-13/h6-9,17H,4-5,10-11H2,1-3H3,(H2,16,18).
What are the key properties of 2-(4-methylanilino)-2-propylpentanamide?
2-(4-methylanilino)-2-propylpentanamide has a molecular weight of 248.37 g/mol, XLogP of 3.23, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylanilino)-2-propylpentanamide is sourced from PubChem (CID 54889215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).