2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile

C10H22N4 — CID 63699790

IUPAC2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile
SMILESCN(C)CCCN(C)CC(C)(N)C#N
InChIInChI=1S/C10H22N4/c1-10(12,8-11)9-14(4)7-5-6-13(2)3/h5-7,9,12H2,1-4H3
InChIKeyGPHYUUFCCUSUCI-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.11
Rot. Bonds6

About 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile

2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile (PubChem CID 63699790) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile.

Molecular Properties

Compound Name2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile
PubChem CID63699790
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Name2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile
SMILESCN(C)CCCN(C)CC(C)(N)C#N
InChIInChI=1S/C10H22N4/c1-10(12,8-11)9-14(4)7-5-6-13(2)3/h5-7,9,12H2,1-4H3
InChIKeyGPHYUUFCCUSUCI-UHFFFAOYSA-N
XLogP0.11
TPSA56.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile 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

2-amino-2-cyclopropyl-3-[3-(dimethylamino)propyl-methylamino]propanenitrile
CID 63907504
2-amino-4-[3-(dimethylamino)propyl-ethylamino]-2-methylpentanenitrile
CID 102996417
1-N-[3-(dimethylamino)propyl]-1-N,2-dimethylpentane-1,2-diamine
CID 63701294
2-(cyclopropylamino)-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile
CID 63700305
N-tert-butyl-N'-[3-(dimethylamino)propyl]-N',2,2-trimethylpropane-1,3-diamine
CID 63699673
2-cyclopropyl-3-[3-(dimethylamino)propyl-methylamino]-2-(ethylamino)propanenitrile
CID 63907930
N'-[3-(dimethylamino)propyl]-N,N,N'-trimethylpropane-1,3-diamine;ethane
CID 171793143
4-[3-(dimethylamino)propyl-methylamino]-3,3-dimethylbutan-2-ol
CID 66453701
2-amino-3-[1-(dimethylamino)propan-2-yl-ethylamino]-2-methylpropanenitrile
CID 103190875
6-[2,2-dimethylpropyl(methyl)amino]-2,2-dimethylhexanenitrile
CID 106709964
6-[2-(dimethylamino)ethyl-methylamino]-2,2-dimethylhexanenitrile
CID 106710028
2-amino-3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]-2-methylpropanenitrile
CID 79315150

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile?
The IUPAC name of 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile (CID 63699790) is 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile.
What is the SMILES notation for 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile?
The canonical SMILES for 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile is CN(C)CCCN(C)CC(C)(N)C#N.
What is the InChIKey of 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile?
The InChIKey is GPHYUUFCCUSUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4/c1-10(12,8-11)9-14(4)7-5-6-13(2)3/h5-7,9,12H2,1-4H3.
What are the key properties of 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile?
2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile has a molecular weight of 198.31 g/mol, XLogP of 0.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[3-(dimethylamino)propyl-methylamino]-2-methylpropanenitrile is sourced from PubChem (CID 63699790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).