N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide

C15H23N3O2 — CID 106280162

IUPACN-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide
SMILESCNC(=O)C(C)(C)CNC(=O)c1ccc(NC)c(C)c1
InChIInChI=1S/C15H23N3O2/c1-10-8-11(6-7-12(10)16-4)13(19)18-9-15(2,3)14(20)17-5/h6-8,16H,9H2,1-5H3,(H,17,20)(H,18,19)
InChIKeyYTGJGBCYUQJCSO-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.54
Rot. Bonds5

About N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide

N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide (PubChem CID 106280162) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide
PubChem CID106280162
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide
SMILESCNC(=O)C(C)(C)CNC(=O)c1ccc(NC)c(C)c1
InChIInChI=1S/C15H23N3O2/c1-10-8-11(6-7-12(10)16-4)13(19)18-9-15(2,3)14(20)17-5/h6-8,16H,9H2,1-5H3,(H,17,20)(H,18,19)
InChIKeyYTGJGBCYUQJCSO-UHFFFAOYSA-N
XLogP1.54
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[3-methyl-4-(methylamino)benzoyl]amino]ethyl carbamate
CID 83214863
2-bromo-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]pyridine-4-carboxamide
CID 113278377
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-4-hydrazinyl-2-methylbenzamide
CID 106280283
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-2,3-dihydro-1H-indole-6-carboxamide
CID 106276798
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-4-(methylamino)pyridine-3-carboxamide
CID 106280202
N-[(4-fluorophenyl)methyl]-3-methyl-4-(methylamino)benzamide
CID 63210456
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 106279641
4-(2,2-dimethylpropanoylamino)-N,3-dimethylbenzamide
CID 61215739
N-[(1-ethylcyclopropyl)methyl]-3-methyl-4-(methylamino)benzamide
CID 114101897
4-(ethylamino)-3-methyl-N-(2-methyl-2-methylsulfonylpropyl)benzamide
CID 79558034
N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide
CID 62848154
4-[(3-chloro-2,2-dimethylpropanoyl)amino]-N-ethyl-3-methylbenzamide
CID 63681118

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide?
The IUPAC name of N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide (CID 106280162) is N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide.
What is the SMILES notation for N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide?
The canonical SMILES for N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide is CNC(=O)C(C)(C)CNC(=O)c1ccc(NC)c(C)c1.
What is the InChIKey of N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide?
The InChIKey is YTGJGBCYUQJCSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10-8-11(6-7-12(10)16-4)13(19)18-9-15(2,3)14(20)17-5/h6-8,16H,9H2,1-5H3,(H,17,20)(H,18,19).
What are the key properties of N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide?
N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide has a molecular weight of 277.37 g/mol, XLogP of 1.54, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]-3-methyl-4-(methylamino)benzamide is sourced from PubChem (CID 106280162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).