2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide

C12H26N2O — CID 103461330

IUPAC2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide
SMILESCCC(C)(C)CNCC(=O)N(C)C(C)C
InChIInChI=1S/C12H26N2O/c1-7-12(4,5)9-13-8-11(15)14(6)10(2)3/h10,13H,7-9H2,1-6H3
InChIKeyNSERNWPYWNNCIO-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.88
Rot. Bonds6

About 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide

2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide (PubChem CID 103461330) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide
PubChem CID103461330
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide
SMILESCCC(C)(C)CNCC(=O)N(C)C(C)C
InChIInChI=1S/C12H26N2O/c1-7-12(4,5)9-13-8-11(15)14(6)10(2)3/h10,13H,7-9H2,1-6H3
InChIKeyNSERNWPYWNNCIO-UHFFFAOYSA-N
XLogP1.88
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-2-(2,2-dimethylbutylamino)acetamide
CID 103461294
N-methyl-2-(2-methylbutylamino)-N-propan-2-ylacetamide
CID 62691596
N-methyl-2-(2-methylprop-2-enylamino)-N-propan-2-ylacetamide
CID 114616817
N-methyl-2-[(2-methylpropan-2-yl)oxyamino]-N-propan-2-ylacetamide
CID 82723226
N-(1-hydroxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 115869500
2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide
CID 103461265
2-(2-acetamidoethylamino)-N-methyl-N-propan-2-ylacetamide
CID 43401676
3-[[2-[methyl(propan-2-yl)amino]-2-oxoethyl]amino]propanamide
CID 43553529
3-(2,2-dimethylbutylamino)-2-methylpropanoic acid
CID 103461240
N-(1-methoxypropan-2-yl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78957945
N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 43179646
2-tert-butylsulfanyl-N-methyl-N-propan-2-ylacetamide
CID 78814922

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide (CID 103461330) is 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide is CCC(C)(C)CNCC(=O)N(C)C(C)C.
What is the InChIKey of 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide?
The InChIKey is NSERNWPYWNNCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-7-12(4,5)9-13-8-11(15)14(6)10(2)3/h10,13H,7-9H2,1-6H3.
What are the key properties of 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide?
2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide has a molecular weight of 214.35 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 103461330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).