N-tert-butyl-2-(4-ethylanilino)propanamide

C15H24N2O — CID 45282110

IUPACN-tert-butyl-2-(4-ethylanilino)propanamide
SMILESCCc1ccc(NC(C)C(=O)NC(C)(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-6-12-7-9-13(10-8-12)16-11(2)14(18)17-15(3,4)5/h7-11,16H,6H2,1-5H3,(H,17,18)
InChIKeyQRIRRYASXQSVRK-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.96
Rot. Bonds4

About N-tert-butyl-2-(4-ethylanilino)propanamide

N-tert-butyl-2-(4-ethylanilino)propanamide (PubChem CID 45282110) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-tert-butyl-2-(4-ethylanilino)propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-(4-ethylanilino)propanamide
PubChem CID45282110
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-tert-butyl-2-(4-ethylanilino)propanamide
SMILESCCc1ccc(NC(C)C(=O)NC(C)(C)C)cc1
InChIInChI=1S/C15H24N2O/c1-6-12-7-9-13(10-8-12)16-11(2)14(18)17-15(3,4)5/h7-11,16H,6H2,1-5H3,(H,17,18)
InChIKeyQRIRRYASXQSVRK-UHFFFAOYSA-N
XLogP2.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(4-acetamidoanilino)-N-tert-butylpropanamide
CID 35994885
(2S)-2-anilino-N-tert-butylpropanamide
CID 28840351
N-tert-butyl-2-[4-(trifluoromethyl)anilino]propanamide
CID 43087018
(2R)-2-(4-ethylanilino)-N-prop-2-enylpropanamide
CID 28843279
(2S)-N-tert-butyl-2-[4-(methanesulfonamido)anilino]propanamide
CID 31268880
(2R)-2-(4-ethylanilino)-N-prop-2-ynylpropanamide
CID 28884943
N-(4-bromophenyl)-2-(4-ethylanilino)propanamide
CID 46799470
N-tert-butyl-2-[4-[(2-methoxyacetyl)amino]anilino]propanamide
CID 42950126
(2R)-N-tert-butyl-2-(4-piperidin-1-ylanilino)propanamide
CID 40809510
(2S)-N-tert-butyl-2-(4-piperidin-1-ylanilino)propanamide
CID 40809509
2-(2,6-diethylanilino)-N-(4-ethylphenyl)propanamide
CID 13252290
N-tert-butyl-2-(naphthalen-2-ylamino)propanamide
CID 43401178

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(4-ethylanilino)propanamide?
The IUPAC name of N-tert-butyl-2-(4-ethylanilino)propanamide (CID 45282110) is N-tert-butyl-2-(4-ethylanilino)propanamide.
What is the SMILES notation for N-tert-butyl-2-(4-ethylanilino)propanamide?
The canonical SMILES for N-tert-butyl-2-(4-ethylanilino)propanamide is CCc1ccc(NC(C)C(=O)NC(C)(C)C)cc1.
What is the InChIKey of N-tert-butyl-2-(4-ethylanilino)propanamide?
The InChIKey is QRIRRYASXQSVRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-6-12-7-9-13(10-8-12)16-11(2)14(18)17-15(3,4)5/h7-11,16H,6H2,1-5H3,(H,17,18).
What are the key properties of N-tert-butyl-2-(4-ethylanilino)propanamide?
N-tert-butyl-2-(4-ethylanilino)propanamide has a molecular weight of 248.37 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(4-ethylanilino)propanamide is sourced from PubChem (CID 45282110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).