N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide

C12H26N2O — CID 115627468

IUPACN-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide
SMILESCC(NCC(=O)NC(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H26N2O/c1-9(11(2,3)4)13-8-10(15)14-12(5,6)7/h9,13H,8H2,1-7H3,(H,14,15)
InChIKeyYBJSCGCDXPAOGE-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.93
Rot. Bonds3

About N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide

N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide (PubChem CID 115627468) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide
PubChem CID115627468
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide
SMILESCC(NCC(=O)NC(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H26N2O/c1-9(11(2,3)4)13-8-10(15)14-12(5,6)7/h9,13H,8H2,1-7H3,(H,14,15)
InChIKeyYBJSCGCDXPAOGE-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-2-(1-hydroxypropan-2-ylamino)acetamide
CID 43499899
N-tert-butyl-2-[[(2R)-1-hydroxypropan-2-yl]amino]acetamide
CID 93083112
N-tert-butyl-2-[(1-methoxy-3-methylbutan-2-yl)amino]acetamide
CID 65048909
2-(3,3-dimethylbutan-2-ylamino)-N-pentan-3-ylacetamide
CID 115627530
N-tert-butyl-2-(1-ethylsulfonylpropan-2-ylamino)acetamide
CID 113350703
N-tert-butyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 28564730
N-tert-butyl-2-(1-cyclobutylethylamino)acetamide
CID 115708515
2-(3,3-dimethylbutan-2-ylamino)-N-(1-methoxypropan-2-yl)acetamide
CID 115627480
N-tert-butyl-2-[[(1R)-1-cycloheptylethyl]amino]acetamide
CID 81393192
2-(3,3-dimethylbutan-2-ylamino)-N-phenylacetamide
CID 115626999
1-(azepan-1-yl)-2-(3,3-dimethylbutan-2-ylamino)ethanone
CID 115626974
2-[[2-(tert-butylamino)-2-oxoethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 115574936

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide (CID 115627468) is N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide is CC(NCC(=O)NC(C)(C)C)C(C)(C)C.
What is the InChIKey of N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide?
The InChIKey is YBJSCGCDXPAOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-9(11(2,3)4)13-8-10(15)14-12(5,6)7/h9,13H,8H2,1-7H3,(H,14,15).
What are the key properties of N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide?
N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide has a molecular weight of 214.35 g/mol, XLogP of 1.93, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(3,3-dimethylbutan-2-ylamino)acetamide is sourced from PubChem (CID 115627468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).