N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide

C15H23N3O2 — CID 62853430

IUPACN-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide
SMILESCCNCC(C)C(=O)Nc1cc(NC(C)=O)ccc1C
InChIInChI=1S/C15H23N3O2/c1-5-16-9-11(3)15(20)18-14-8-13(17-12(4)19)7-6-10(14)2/h6-8,11,16H,5,9H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyQZPKCJQCXGZDEN-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.14
Rot. Bonds6

About N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide

N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide (PubChem CID 62853430) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide
PubChem CID62853430
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide
SMILESCCNCC(C)C(=O)Nc1cc(NC(C)=O)ccc1C
InChIInChI=1S/C15H23N3O2/c1-5-16-9-11(3)15(20)18-14-8-13(17-12(4)19)7-6-10(14)2/h6-8,11,16H,5,9H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyQZPKCJQCXGZDEN-UHFFFAOYSA-N
XLogP2.14
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethylphenyl)-3-(ethylamino)-2-methylpropanamide
CID 62852690
N-(3-acetamidophenyl)-3-(ethylamino)-2-methylpropanamide
CID 62851264
3-(ethylamino)-N-(5-methoxy-2-methylphenyl)-2-methylpropanamide
CID 114252727
2-methyl-3-(methylamino)-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]propanamide
CID 119725778
3-(ethylamino)-2-methyl-N-(2-methylphenyl)propanamide
CID 45097653
N-(5-acetamido-2-methylphenyl)-2-chloropropanamide
CID 43696197
(2S,3S)-N-(5-acetamido-2-methylphenyl)-2-amino-3-methylpentanamide
CID 61154615
N-(5-acetamido-2-methylphenyl)-2-amino-3-methylbutanamide
CID 43697583
(2S)-N-(3-acetamido-4-methylphenyl)-2-aminobutanamide
CID 79024532
N-(3-acetamido-4-methylphenyl)-2-bromobutanamide
CID 55125591
(2S)-N-(3-acetamido-4-methylphenyl)-2-amino-3-methylpentanamide
CID 61174777
N-(5-acetamido-2-methylphenyl)-3-methylbutanamide
CID 47191002

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide?
The IUPAC name of N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide (CID 62853430) is N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide.
What is the SMILES notation for N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide?
The canonical SMILES for N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide is CCNCC(C)C(=O)Nc1cc(NC(C)=O)ccc1C.
What is the InChIKey of N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide?
The InChIKey is QZPKCJQCXGZDEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-5-16-9-11(3)15(20)18-14-8-13(17-12(4)19)7-6-10(14)2/h6-8,11,16H,5,9H2,1-4H3,(H,17,19)(H,18,20).
What are the key properties of N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide?
N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide has a molecular weight of 277.37 g/mol, XLogP of 2.14, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methylphenyl)-3-(ethylamino)-2-methylpropanamide is sourced from PubChem (CID 62853430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).