2-[3-(dimethylamino)propyl-ethylamino]propanenitrile

C10H21N3 — CID 102993262

IUPAC2-[3-(dimethylamino)propyl-ethylamino]propanenitrile
SMILESCCN(CCCN(C)C)C(C)C#N
InChIInChI=1S/C10H21N3/c1-5-13(10(2)9-11)8-6-7-12(3)4/h10H,5-8H2,1-4H3
InChIKeyCTYVEUAEWFWEIW-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.17
Rot. Bonds6

About 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile

2-[3-(dimethylamino)propyl-ethylamino]propanenitrile (PubChem CID 102993262) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile.

Molecular Properties

Compound Name2-[3-(dimethylamino)propyl-ethylamino]propanenitrile
PubChem CID102993262
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name2-[3-(dimethylamino)propyl-ethylamino]propanenitrile
SMILESCCN(CCCN(C)C)C(C)C#N
InChIInChI=1S/C10H21N3/c1-5-13(10(2)9-11)8-6-7-12(3)4/h10H,5-8H2,1-4H3
InChIKeyCTYVEUAEWFWEIW-UHFFFAOYSA-N
XLogP1.17
TPSA30.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-ethyl-N,N-dimethyl-N'-propan-2-ylpropane-1,3-diamine
CID 59289592
2-[ethyl(2-hydroxypropyl)amino]propanenitrile
CID 131211886
2-amino-4-[3-(dimethylamino)propyl-ethylamino]-2-methylpentanenitrile
CID 102996417
3-[3-(dimethylamino)propyl-ethylamino]-2-methylpropanenitrile
CID 115630903
2-[3-(dimethylamino)propyl-ethylamino]propanoic acid
CID 102994663
6-(dimethylamino)-2-methylhexanenitrile
CID 54049734
2-N-[3-(dimethylamino)propyl]-2-N-ethyl-1-N-(3-methylbutyl)propane-1,2-diamine
CID 102997823
4-(dimethylamino)butanenitrile;hydrobromide
CID 46786342
3-N,3-N-diethyl-1-N,1-N-dimethylbutane-1,3-diamine
CID 91045887
3-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methylpropanenitrile
CID 103188911
3-[3-(dimethylamino)propyl-ethylamino]heptan-4-ol
CID 102996274
2-[1-cyanoethyl(ethyl)amino]-N-propan-2-ylacetamide
CID 60646285

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile?
The IUPAC name of 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile (CID 102993262) is 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile.
What is the SMILES notation for 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile?
The canonical SMILES for 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile is CCN(CCCN(C)C)C(C)C#N.
What is the InChIKey of 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile?
The InChIKey is CTYVEUAEWFWEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3/c1-5-13(10(2)9-11)8-6-7-12(3)4/h10H,5-8H2,1-4H3.
What are the key properties of 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile?
2-[3-(dimethylamino)propyl-ethylamino]propanenitrile has a molecular weight of 183.30 g/mol, XLogP of 1.17, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(dimethylamino)propyl-ethylamino]propanenitrile is sourced from PubChem (CID 102993262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).