2-(2,3-dimethylbutylamino)-N-methylacetamide

C9H20N2O — CID 64568537

IUPAC2-(2,3-dimethylbutylamino)-N-methylacetamide
SMILESCNC(=O)CNCC(C)C(C)C
InChIInChI=1S/C9H20N2O/c1-7(2)8(3)5-11-6-9(12)10-4/h7-8,11H,5-6H2,1-4H3,(H,10,12)
InChIKeyUDOOVUFEIZOCIG-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.61
Rot. Bonds5

About 2-(2,3-dimethylbutylamino)-N-methylacetamide

2-(2,3-dimethylbutylamino)-N-methylacetamide (PubChem CID 64568537) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(2,3-dimethylbutylamino)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,3-dimethylbutylamino)-N-methylacetamide
PubChem CID64568537
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-(2,3-dimethylbutylamino)-N-methylacetamide
SMILESCNC(=O)CNCC(C)C(C)C
InChIInChI=1S/C9H20N2O/c1-7(2)8(3)5-11-6-9(12)10-4/h7-8,11H,5-6H2,1-4H3,(H,10,12)
InChIKeyUDOOVUFEIZOCIG-UHFFFAOYSA-N
XLogP0.61
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[2-(aminomethyl)-3-methylbutyl]amino]-N-methylacetamide
CID 107441337
N-methyl-2-[[2-(3-methylbutan-2-ylamino)-2-oxoethyl]amino]acetamide
CID 60695644
N-cycloheptyl-2-(2,3-dimethylbutylamino)acetamide
CID 64596656
N-methyl-2-[(3-methyl-2-phenylbutyl)amino]acetamide
CID 107875908
N-(2-chloroprop-2-enyl)-2,3-dimethylbutan-1-amine
CID 64568928
N-methyl-2-(propylamino)acetamide
CID 28586328
2-[(3-cyclopentyl-2-hydroxypropyl)amino]-N-methylacetamide
CID 103157245
2-[(2-hydroxy-3-pyrrolidin-1-ylpropyl)amino]-N-methylacetamide
CID 60901241
N-methyl-2-(methylamino)acetamide
CID 2463138
N-methyl-2-(sulfanylamino)acetamide
CID 122659165
N-ethyl-2-[(3-methyl-2-propan-2-ylbutyl)amino]acetamide
CID 102905286
N-hydroxy-2-(2-hydroxypropylamino)acetamide
CID 142100619

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylbutylamino)-N-methylacetamide?
The IUPAC name of 2-(2,3-dimethylbutylamino)-N-methylacetamide (CID 64568537) is 2-(2,3-dimethylbutylamino)-N-methylacetamide.
What is the SMILES notation for 2-(2,3-dimethylbutylamino)-N-methylacetamide?
The canonical SMILES for 2-(2,3-dimethylbutylamino)-N-methylacetamide is CNC(=O)CNCC(C)C(C)C.
What is the InChIKey of 2-(2,3-dimethylbutylamino)-N-methylacetamide?
The InChIKey is UDOOVUFEIZOCIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-7(2)8(3)5-11-6-9(12)10-4/h7-8,11H,5-6H2,1-4H3,(H,10,12).
What are the key properties of 2-(2,3-dimethylbutylamino)-N-methylacetamide?
2-(2,3-dimethylbutylamino)-N-methylacetamide has a molecular weight of 172.27 g/mol, XLogP of 0.61, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylbutylamino)-N-methylacetamide is sourced from PubChem (CID 64568537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).