2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide

C11H22N2O2 — CID 2931018

IUPAC2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide
SMILESCC(CNC(=O)C(C)C)NC(=O)C(C)C
InChIInChI=1S/C11H22N2O2/c1-7(2)10(14)12-6-9(5)13-11(15)8(3)4/h7-9H,6H2,1-5H3,(H,12,14)(H,13,15)
InChIKeyJYXWJDZWHLHPPX-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.92
Rot. Bonds5

About 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide

2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide (PubChem CID 2931018) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide
PubChem CID2931018
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide
SMILESCC(CNC(=O)C(C)C)NC(=O)C(C)C
InChIInChI=1S/C11H22N2O2/c1-7(2)10(14)12-6-9(5)13-11(15)8(3)4/h7-9H,6H2,1-5H3,(H,12,14)(H,13,15)
InChIKeyJYXWJDZWHLHPPX-UHFFFAOYSA-N
XLogP0.92
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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(2S)-2-amino-N-[3-[4-(3-aminopropylamino)butylamino]propyl]propanamide
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Ethanediamide, N1,N2-bis(2-methylpropyl)-
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[(1R,2S)-1-(2-aminopropanoylamino)-2-methylbutyl]boronic acid
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N-(Carbamoylmethyl)-2-acetamido-3-methylbutanamide
CID 644829
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CID 228244
N-[2-(butanoylamino)ethyl]butanamide
CID 280045
2-((1-Hydroxyethylidene)amino)-N-methylpropanimidic acid
CID 141892
2-Amino-N-ethylpropanamide
CID 541608
US8722896, N-[(2S)-2-Aminopropanoyl]-(2S)-valylamide
CID 58080388
N,N'-diisopropyloxamide
CID 245845

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide?
The IUPAC name of 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide (CID 2931018) is 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide?
The canonical SMILES for 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide is CC(CNC(=O)C(C)C)NC(=O)C(C)C.
What is the InChIKey of 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide?
The InChIKey is JYXWJDZWHLHPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-7(2)10(14)12-6-9(5)13-11(15)8(3)4/h7-9H,6H2,1-5H3,(H,12,14)(H,13,15).
What are the key properties of 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide?
2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide has a molecular weight of 214.31 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-methylpropanoylamino)propyl]propanamide is sourced from PubChem (CID 2931018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).