2-(diethylamino)-2,3-dimethylbutanenitrile

C10H20N2 — CID 43802750

IUPAC2-(diethylamino)-2,3-dimethylbutanenitrile
SMILESCCN(CC)C(C)(C#N)C(C)C
InChIInChI=1S/C10H20N2/c1-6-12(7-2)10(5,8-11)9(3)4/h9H,6-7H2,1-5H3
InChIKeyGVJFOWVMLJUTGS-UHFFFAOYSA-N
MW168.28 g/mol
LogP2.27
Rot. Bonds4

About 2-(diethylamino)-2,3-dimethylbutanenitrile

2-(diethylamino)-2,3-dimethylbutanenitrile (PubChem CID 43802750) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 2-(diethylamino)-2,3-dimethylbutanenitrile.

Molecular Properties

Compound Name2-(diethylamino)-2,3-dimethylbutanenitrile
PubChem CID43802750
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name2-(diethylamino)-2,3-dimethylbutanenitrile
SMILESCCN(CC)C(C)(C#N)C(C)C
InChIInChI=1S/C10H20N2/c1-6-12(7-2)10(5,8-11)9(3)4/h9H,6-7H2,1-5H3
InChIKeyGVJFOWVMLJUTGS-UHFFFAOYSA-N
XLogP2.27
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(dimethylamino)-2,3-dimethylbutanenitrile
CID 43802640
2-[tert-butyl(ethyl)amino]propanenitrile
CID 130756537
2,2-dimethylbutanenitrile;ethane
CID 144998313
2-ethyl-3-methyl-2-(propan-2-ylamino)butanenitrile
CID 60925665
4-(dimethylamino)-2-methyl-2-(propan-2-ylamino)pentanenitrile
CID 64727261
2-(ethylamino)-3-methyl-2-propan-2-ylbutanenitrile
CID 141254263
2,3-dimethyl-2-(propan-2-ylamino)pentanenitrile
CID 60915967
4-(diethylamino)-2-(ethylamino)-2-methylpentanenitrile
CID 64696931
2,3-dimethyl-2-silylbutanenitrile
CID 175377699
(2R)-2-hydroxy-2,3-dimethylbutanenitrile
CID 12650901
(2R)-2-amino-2,3-dimethylbutanenitrile
CID 735791
2,2-dimethylbutanenitrile;2,2-dimethylpropanenitrile
CID 159256086

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-2,3-dimethylbutanenitrile?
The IUPAC name of 2-(diethylamino)-2,3-dimethylbutanenitrile (CID 43802750) is 2-(diethylamino)-2,3-dimethylbutanenitrile.
What is the SMILES notation for 2-(diethylamino)-2,3-dimethylbutanenitrile?
The canonical SMILES for 2-(diethylamino)-2,3-dimethylbutanenitrile is CCN(CC)C(C)(C#N)C(C)C.
What is the InChIKey of 2-(diethylamino)-2,3-dimethylbutanenitrile?
The InChIKey is GVJFOWVMLJUTGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-6-12(7-2)10(5,8-11)9(3)4/h9H,6-7H2,1-5H3.
What are the key properties of 2-(diethylamino)-2,3-dimethylbutanenitrile?
2-(diethylamino)-2,3-dimethylbutanenitrile has a molecular weight of 168.28 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-2,3-dimethylbutanenitrile is sourced from PubChem (CID 43802750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).