2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide

C12H26N2O — CID 61486851

IUPAC2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CNCC(C)(C)C
InChIInChI=1S/C12H26N2O/c1-10(2)6-7-14-11(15)8-13-9-12(3,4)5/h10,13H,6-9H2,1-5H3,(H,14,15)
InChIKeyJGOCUWQIYDOOTI-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.78
Rot. Bonds6

About 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide

2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide (PubChem CID 61486851) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide
PubChem CID61486851
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide
SMILESCC(C)CCNC(=O)CNCC(C)(C)C
InChIInChI=1S/C12H26N2O/c1-10(2)6-7-14-11(15)8-13-9-12(3,4)5/h10,13H,6-9H2,1-5H3,(H,14,15)
InChIKeyJGOCUWQIYDOOTI-UHFFFAOYSA-N
XLogP1.78
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-hydroxy-2,2-dimethylbutyl)amino]-N-(3-methylbutyl)acetamide
CID 106146856
2-[(4-methoxy-2,2-dimethylbutyl)amino]-N-(3-methylbutyl)acetamide
CID 114125368
3,3-dimethyl-N-(3-methylbutyl)butanamide
CID 4634731
N-butyl-2-(2,2-dimethylpropylamino)acetamide
CID 61485526
4,4-dimethyl-6-[[2-(3-methylbutylamino)-2-oxoethyl]amino]hexanoic acid
CID 65287517
2-(3-methylbutylamino)-N-propylacetamide
CID 28576469
4,4-dimethyl-N-(3-methylbutyl)pentanamide
CID 135139773
N-(3-methylbutyl)-2-(5-methylhexan-2-ylamino)acetamide
CID 60672212
2-(3-methylbutylamino)-N-pentylacetamide
CID 109005799
N-(3-methylbutyl)-2-(2-methylpentan-3-ylamino)acetamide
CID 61487192
N-(3-methylbutyl)-2-(pentan-3-ylamino)acetamide
CID 60672078
(2S)-2-[[2-(3-methylbutylamino)-2-oxoethyl]amino]propanoic acid
CID 83194407

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide?
The IUPAC name of 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide (CID 61486851) is 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide.
What is the SMILES notation for 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide?
The canonical SMILES for 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide is CC(C)CCNC(=O)CNCC(C)(C)C.
What is the InChIKey of 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide?
The InChIKey is JGOCUWQIYDOOTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-10(2)6-7-14-11(15)8-13-9-12(3,4)5/h10,13H,6-9H2,1-5H3,(H,14,15).
What are the key properties of 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide?
2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide has a molecular weight of 214.35 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropylamino)-N-(3-methylbutyl)acetamide is sourced from PubChem (CID 61486851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).