2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide

C12H26N2O2 — CID 103825116

IUPAC2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
SMILESCC(C)(CCO)CNC(=O)CNC(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-11(2,3)14-8-10(16)13-9-12(4,5)6-7-15/h14-15H,6-9H2,1-5H3,(H,13,16)
InChIKeyIGILVGAVFWLABE-UHFFFAOYSA-N
MW230.35 g/mol
LogP0.90
Rot. Bonds6

About 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide

2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide (PubChem CID 103825116) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
PubChem CID103825116
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
SMILESCC(C)(CCO)CNC(=O)CNC(C)(C)C
InChIInChI=1S/C12H26N2O2/c1-11(2,3)14-8-10(16)13-9-12(4,5)6-7-15/h14-15H,6-9H2,1-5H3,(H,13,16)
InChIKeyIGILVGAVFWLABE-UHFFFAOYSA-N
XLogP0.90
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-hydroxy-2,2-dimethylbutyl)-2-(2,2,2-trifluoroethylamino)acetamide
CID 113278483
3-chloro-N-(4-hydroxy-2,2-dimethylbutyl)propanamide
CID 106145976
2-anilino-N-(4-hydroxy-2,2-dimethylbutyl)acetamide
CID 106148046
4-[(4-hydroxy-2,2-dimethylbutyl)amino]-2,2-dimethyl-4-oxobutanoic acid
CID 106142171
N-(4-hydroxy-2,2-dimethylbutyl)-4-oxobutanamide
CID 154969198
4-chloro-N-[2-[(4-hydroxy-2,2-dimethylbutyl)amino]-2-oxoethyl]benzamide
CID 103825506
N-tert-butyl-2-[(4-hydroxy-2,2-dimethylbutyl)amino]acetamide
CID 106146940
N-[2-[(5-hydroxy-2,2-dimethylpentyl)amino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 103899932
5-amino-N-(4-hydroxy-2,2-dimethylbutyl)pentanamide
CID 106147943
2-(tert-butylamino)-N-propylacetamide
CID 28586578
N-[2-[(4-hydroxy-2,2-dimethylbutyl)amino]-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 103825297
N-(4-hydroxy-2,2-dimethylbutyl)-2-(2-hydroxyphenyl)acetamide
CID 103772553

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
The IUPAC name of 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide (CID 103825116) is 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide is CC(C)(CCO)CNC(=O)CNC(C)(C)C.
What is the InChIKey of 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
The InChIKey is IGILVGAVFWLABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-11(2,3)14-8-10(16)13-9-12(4,5)6-7-15/h14-15H,6-9H2,1-5H3,(H,13,16).
What are the key properties of 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide?
2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide has a molecular weight of 230.35 g/mol, XLogP of 0.90, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-(4-hydroxy-2,2-dimethylbutyl)acetamide is sourced from PubChem (CID 103825116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).