4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide

C16H24N2O2 — CID 8750199

IUPAC4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide
SMILESCCNC(=O)[C@@H](C)NC(=O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C16H24N2O2/c1-6-17-14(19)11(2)18-15(20)12-7-9-13(10-8-12)16(3,4)5/h7-11H,6H2,1-5H3,(H,17,19)(H,18,20)/t11-/m1/s1
InChIKeyMOZQUOMQTVTIPN-LLVKDONJSA-N
MW276.38 g/mol
LogP2.24
Rot. Bonds4

About 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide

4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide (PubChem CID 8750199) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide.

Molecular Properties

Compound Name4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide
PubChem CID8750199
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide
SMILESCCNC(=O)[C@@H](C)NC(=O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C16H24N2O2/c1-6-17-14(19)11(2)18-15(20)12-7-9-13(10-8-12)16(3,4)5/h7-11H,6H2,1-5H3,(H,17,19)(H,18,20)/t11-/m1/s1
InChIKeyMOZQUOMQTVTIPN-LLVKDONJSA-N
XLogP2.24
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(ethylamino)-1-oxopropan-2-yl]-4-hydroxybenzamide
CID 60709622
4-bromo-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide
CID 51464444
4-tert-butyl-N-[(2S)-1-[2-(dimethylamino)ethylamino]-1-oxopropan-2-yl]benzamide
CID 2392296
4-tert-butyl-N-[1-[(4-hydroxy-2-methylpentyl)amino]-1-oxopropan-2-yl]benzamide
CID 111447068
4-[[2-[(4-tert-butylbenzoyl)amino]propanoylamino]methyl]-N-methylbenzamide
CID 55575519
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(methoxymethyl)benzamide
CID 8751184
4-(dimethylsulfamoyl)-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide
CID 41192964
methyl 4-[2-[2-[(4-tert-butylbenzoyl)amino]propanoylamino]ethyl]benzoate
CID 46449947
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-3-(trifluoromethyl)benzamide
CID 8750240
3,5-dibromo-N-[1-(ethylamino)-1-oxopropan-2-yl]benzamide
CID 103907452
4-tert-butyl-N-[1-[[2-(dimethylamino)-3-pyridinyl]methylamino]-1-oxopropan-2-yl]benzamide
CID 46470503
N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 8751476

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide?
The IUPAC name of 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide (CID 8750199) is 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide.
What is the SMILES notation for 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide?
The canonical SMILES for 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide is CCNC(=O)[C@@H](C)NC(=O)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide?
The InChIKey is MOZQUOMQTVTIPN-LLVKDONJSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-6-17-14(19)11(2)18-15(20)12-7-9-13(10-8-12)16(3,4)5/h7-11H,6H2,1-5H3,(H,17,19)(H,18,20)/t11-/m1/s1.
What are the key properties of 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide?
4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]benzamide is sourced from PubChem (CID 8750199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).