2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide

C14H31N3O — CID 60672282

IUPAC2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCC(C)(C)CN(C)C
InChIInChI=1S/C14H31N3O/c1-8-14(4,5)16-12(18)9-15-10-13(2,3)11-17(6)7/h15H,8-11H2,1-7H3,(H,16,18)
InChIKeyMXPKWKSVIYMCIW-UHFFFAOYSA-N
MW257.42 g/mol
LogP1.47
Rot. Bonds8

About 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide

2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide (PubChem CID 60672282) has the molecular formula C14H31N3O and a molecular weight of 257.42 g/mol. Its IUPAC name is 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide
PubChem CID60672282
Molecular FormulaC14H31N3O
Molecular Weight257.42 g/mol
Exact Mass257.25
IUPAC Name2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCC(C)(C)NC(=O)CNCC(C)(C)CN(C)C
InChIInChI=1S/C14H31N3O/c1-8-14(4,5)16-12(18)9-15-10-13(2,3)11-17(6)7/h15H,8-11H2,1-7H3,(H,16,18)
InChIKeyMXPKWKSVIYMCIW-UHFFFAOYSA-N
XLogP1.47
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.42
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-hydroxy-2,2-dimethylpentyl)amino]-N-(2-methylbutan-2-yl)acetamide
CID 106147113
N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 43179646
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 28572507
2-(2,2-dimethylhydrazinyl)-N-(2-methylbutan-2-yl)acetamide
CID 83015090
2-(2-hydroxyethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60671300
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-phenylacetamide
CID 28572618
N-(2-cyanoethyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 28572608
N-[3-(dimethylamino)-2,2-dimethylpropyl]propanamide
CID 59842400
N-(3-chloro-2-methylprop-2-enyl)-N',N',2,2-tetramethylpropane-1,3-diamine
CID 106437308
N-cyclopropyl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-ethylacetamide
CID 54957022
N-(2-methylbutan-2-yl)-2-[(2-methyl-2-phenylpropyl)amino]acetamide
CID 60976584
2-[1-(dimethylamino)propan-2-ylamino]-N-(2-methylbutan-2-yl)acetamide
CID 82938261

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide (CID 60672282) is 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide is CCC(C)(C)NC(=O)CNCC(C)(C)CN(C)C.
What is the InChIKey of 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is MXPKWKSVIYMCIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N3O/c1-8-14(4,5)16-12(18)9-15-10-13(2,3)11-17(6)7/h15H,8-11H2,1-7H3,(H,16,18).
What are the key properties of 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide?
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 257.42 g/mol, XLogP of 1.47, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 60672282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).