2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide

C9H20N2O2 — CID 115744584

IUPAC2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide
SMILESCC(C)C(O)CNC(=O)CN(C)C
InChIInChI=1S/C9H20N2O2/c1-7(2)8(12)5-10-9(13)6-11(3)4/h7-8,12H,5-6H2,1-4H3,(H,10,13)
InChIKeyHXEVROMNHVZWDM-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.32
Rot. Bonds5

About 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide

2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide (PubChem CID 115744584) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide
PubChem CID115744584
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide
SMILESCC(C)C(O)CNC(=O)CN(C)C
InChIInChI=1S/C9H20N2O2/c1-7(2)8(12)5-10-9(13)6-11(3)4/h7-8,12H,5-6H2,1-4H3,(H,10,13)
InChIKeyHXEVROMNHVZWDM-UHFFFAOYSA-N
XLogP-0.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dimethylamino)-N-(2-methylpropyl)acetamide
CID 20735570
3-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)propanamide
CID 115746120
N-(2-hydroxy-3-methylbutyl)propanamide
CID 115701495
2-(dimethylamino)-N-[2-methyl-3-(methylamino)propyl]acetamide
CID 115302668
N-[(2R)-2-hydroxy-3-methylbutyl]-4-methylpentanamide
CID 97014440
N-[(2S)-2-hydroxy-3-methylbutyl]-4-methylpentanamide
CID 97014441
1,1-diethyl-3-(2-hydroxy-3-methylbutyl)urea
CID 115755100
(2-hydroxy-3-methylbutyl)carbamic acid
CID 135330394
N-[2-[[(2R)-2-hydroxy-3-methylbutyl]amino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 97078266
N-(aminomethyl)-2-(dimethylamino)acetamide
CID 170647333
2-(dimethylamino)-N-sulfanylacetamide
CID 122523044
N-[2-(2-hydroxypropylamino)-2-oxoethyl]-N-methylprop-2-enamide
CID 140967040

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide?
The IUPAC name of 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide (CID 115744584) is 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide.
What is the SMILES notation for 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide?
The canonical SMILES for 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide is CC(C)C(O)CNC(=O)CN(C)C.
What is the InChIKey of 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide?
The InChIKey is HXEVROMNHVZWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-7(2)8(12)5-10-9(13)6-11(3)4/h7-8,12H,5-6H2,1-4H3,(H,10,13).
What are the key properties of 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide?
2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide has a molecular weight of 188.27 g/mol, XLogP of -0.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(2-hydroxy-3-methylbutyl)acetamide is sourced from PubChem (CID 115744584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).