2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide

C15H23N3O2 — CID 119780770

IUPAC2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide
SMILESCNCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1
InChIInChI=1S/C15H23N3O2/c1-10-6-7-11(17-13(19)9-16-5)8-12(10)18-14(20)15(2,3)4/h6-8,16H,9H2,1-5H3,(H,17,19)(H,18,20)
InChIKeyGKJZGNABNBZQFI-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.14
Rot. Bonds4

About 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide

2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide (PubChem CID 119780770) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide
PubChem CID119780770
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide
SMILESCNCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1
InChIInChI=1S/C15H23N3O2/c1-10-6-7-11(17-13(19)9-16-5)8-12(10)18-14(20)15(2,3)4/h6-8,16H,9H2,1-5H3,(H,17,19)(H,18,20)
InChIKeyGKJZGNABNBZQFI-UHFFFAOYSA-N
XLogP2.14
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
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-[5-[[2-(1-hydroxycyclopentyl)acetyl]amino]-2-methylphenyl]-2,2-dimethylpropanamide
CID 111538466
7-amino-N-[3-(2,2-dimethylpropanoylamino)-4-methylphenyl]heptanamide
CID 119780750
N-[5-(2,2-dimethylpropanoylamino)-2-methylphenyl]-3,4,4-trimethylpentanamide
CID 86938339
2-methyl-2-(methylamino)-N-[2-methyl-5-(propanoylamino)phenyl]propanamide
CID 62836559
2,2-dimethyl-N-[3-[[2-[4-methyl-3-(propanoylamino)anilino]acetyl]amino]phenyl]propanamide
CID 54844972
(2S)-2-amino-N-[3-(2,2-dimethylpropanoylamino)-4-methylphenyl]-3,3-dimethylbutanamide
CID 119780776
1-amino-N-[3-(2,2-dimethylpropanoylamino)-4-methylphenyl]cyclopropane-1-carboxamide
CID 119780748
N-[5-[[4-(hydroxymethyl)phenyl]methylamino]-2-methylphenyl]-2,2-dimethylpropanamide
CID 110006658
N-[3-[[2-(4-aminophenyl)acetyl]amino]-4-methylphenyl]-2,2-dimethylpropanamide;hydrochloride
CID 119780709
N-(2,5-dimethylphenyl)-2-(methylamino)acetamide
CID 2396341
N-[5-[(2-hydroxy-2-phenylacetyl)amino]-2-methylphenyl]-2,2-dimethylpropanamide
CID 111538465
N-[3-[[2-(2,5-dimethylanilino)acetyl]amino]phenyl]-2,2-dimethylpropanamide
CID 54812945

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide (CID 119780770) is 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide is CNCC(=O)Nc1ccc(C)c(NC(=O)C(C)(C)C)c1.
What is the InChIKey of 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide?
The InChIKey is GKJZGNABNBZQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10-6-7-11(17-13(19)9-16-5)8-12(10)18-14(20)15(2,3)4/h6-8,16H,9H2,1-5H3,(H,17,19)(H,18,20).
What are the key properties of 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide?
2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide has a molecular weight of 277.37 g/mol, XLogP of 2.14, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-methyl-5-[[2-(methylamino)acetyl]amino]phenyl]propanamide is sourced from PubChem (CID 119780770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).