2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide

C15H24N2O — CID 54908499

IUPAC2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide
SMILESCCC(C)NC(C)(C(N)=O)c1cc(C)ccc1C
InChIInChI=1S/C15H24N2O/c1-6-12(4)17-15(5,14(16)18)13-9-10(2)7-8-11(13)3/h7-9,12,17H,6H2,1-5H3,(H2,16,18)
InChIKeyHTEFIOPRAMRWAB-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.39
Rot. Bonds5

About 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide

2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide (PubChem CID 54908499) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide.

Molecular Properties

Compound Name2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide
PubChem CID54908499
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide
SMILESCCC(C)NC(C)(C(N)=O)c1cc(C)ccc1C
InChIInChI=1S/C15H24N2O/c1-6-12(4)17-15(5,14(16)18)13-9-10(2)7-8-11(13)3/h7-9,12,17H,6H2,1-5H3,(H2,16,18)
InChIKeyHTEFIOPRAMRWAB-UHFFFAOYSA-N
XLogP2.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(diethylamino)ethylamino]-2-(2,5-dimethylphenyl)propanamide
CID 60995327
ethyl 2-(butan-2-ylamino)-2-(2-methoxy-5-methylphenyl)propanoate
CID 61025042
2-(butan-2-ylamino)-2-(3,4-difluorophenyl)propanamide
CID 54908455
ethyl 2-(butan-2-ylamino)-2-(4-methylphenyl)propanoate
CID 54907922
2-(butan-2-ylamino)-2-(2-fluoro-6-methoxyphenyl)propanamide
CID 113388819
4-(2,4-dimethylphenyl)sulfanyl-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64709114
N-[(2S)-butan-2-yl]-2,5-dimethylbenzamide
CID 925430
ethyl 2-(butan-2-ylamino)-2-(2,5-dichlorophenyl)propanoate
CID 61025629
ethyl 2-(2,5-dimethylphenyl)-2-methylpropanoate
CID 62550626
ethyl 2-(2,5-dimethylphenyl)-2-(prop-2-ynylamino)propanoate
CID 55063389
2-(butan-2-ylamino)-2-(2-methoxy-5-methylphenyl)propan-1-ol
CID 61048608
ethyl 2-(2,5-dimethylphenyl)-2-(2-methoxyethylamino)propanoate
CID 62541176

Frequently Asked Questions

What is the IUPAC name of 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide?
The IUPAC name of 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide (CID 54908499) is 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide.
What is the SMILES notation for 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide?
The canonical SMILES for 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide is CCC(C)NC(C)(C(N)=O)c1cc(C)ccc1C.
What is the InChIKey of 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide?
The InChIKey is HTEFIOPRAMRWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-6-12(4)17-15(5,14(16)18)13-9-10(2)7-8-11(13)3/h7-9,12,17H,6H2,1-5H3,(H2,16,18).
What are the key properties of 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide?
2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(butan-2-ylamino)-2-(2,5-dimethylphenyl)propanamide is sourced from PubChem (CID 54908499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).