N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide

C15H23N3O2 — CID 62848154

IUPACN-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide
SMILESCCNC(=O)c1ccc(NC(=O)C(C)(C)NC)c(C)c1
InChIInChI=1S/C15H23N3O2/c1-6-17-13(19)11-7-8-12(10(2)9-11)18-14(20)15(3,4)16-5/h7-9,16H,6H2,1-5H3,(H,17,19)(H,18,20)
InChIKeyOCIVNHURFDPPLD-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.68
Rot. Bonds5

About N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide

N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide (PubChem CID 62848154) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide.

Molecular Properties

Compound NameN-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide
PubChem CID62848154
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide
SMILESCCNC(=O)c1ccc(NC(=O)C(C)(C)NC)c(C)c1
InChIInChI=1S/C15H23N3O2/c1-6-17-13(19)11-7-8-12(10(2)9-11)18-14(20)15(3,4)16-5/h7-9,16H,6H2,1-5H3,(H,17,19)(H,18,20)
InChIKeyOCIVNHURFDPPLD-UHFFFAOYSA-N
XLogP1.68
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 ≤ 51.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-chloro-2,2-dimethylpropanoyl)amino]-N-ethyl-3-methylbenzamide
CID 63681118
3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzoic acid
CID 62845966
N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride
CID 119714183
4-[[(2S)-2-amino-3,3-dimethylbutanoyl]amino]-N-ethyl-3-methylbenzamide
CID 61179048
4-[[2-(ethylamino)-2-methylpropanoyl]amino]-3-methylbenzoic acid
CID 62834340
4-(3-aminopropanoylamino)-N-ethyl-3-methylbenzamide
CID 54862801
4-(2,2-dimethylpropanoylamino)-N,3-dimethylbenzamide
CID 61215739
N-(4-iodo-2-methylphenyl)-2-methyl-2-(methylamino)propanamide
CID 62836927
N-ethyl-3-methyl-4-(2-methylpropylcarbamoylamino)benzamide
CID 47264617
4-[2-(aminomethyl)pentanoylamino]-N-ethyl-3-methylbenzamide
CID 65229718
4-[(2-amino-2-ethylbutanoyl)amino]-3-methylbenzoic acid
CID 79810418
4-(ethylamino)-3-methyl-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 55163644

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide?
The IUPAC name of N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide (CID 62848154) is N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide.
What is the SMILES notation for N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide?
The canonical SMILES for N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide is CCNC(=O)c1ccc(NC(=O)C(C)(C)NC)c(C)c1.
What is the InChIKey of N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide?
The InChIKey is OCIVNHURFDPPLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-6-17-13(19)11-7-8-12(10(2)9-11)18-14(20)15(3,4)16-5/h7-9,16H,6H2,1-5H3,(H,17,19)(H,18,20).
What are the key properties of N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide?
N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide has a molecular weight of 277.37 g/mol, XLogP of 1.68, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide is sourced from PubChem (CID 62848154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).