2-cyclopropyl-2-(cyclopropylamino)propanenitrile

C9H14N2 — CID 43151653

IUPAC2-cyclopropyl-2-(cyclopropylamino)propanenitrile
SMILESCC(C#N)(NC1CC1)C1CC1
InChIInChI=1S/C9H14N2/c1-9(6-10,7-2-3-7)11-8-4-5-8/h7-8,11H,2-5H2,1H3
InChIKeyZZGFBIWQPXCYAK-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.43
Rot. Bonds3

About 2-cyclopropyl-2-(cyclopropylamino)propanenitrile

2-cyclopropyl-2-(cyclopropylamino)propanenitrile (PubChem CID 43151653) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)propanenitrile.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)propanenitrile
PubChem CID43151653
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)propanenitrile
SMILESCC(C#N)(NC1CC1)C1CC1
InChIInChI=1S/C9H14N2/c1-9(6-10,7-2-3-7)11-8-4-5-8/h7-8,11H,2-5H2,1H3
InChIKeyZZGFBIWQPXCYAK-UHFFFAOYSA-N
XLogP1.43
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)propanenitrile?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)propanenitrile (CID 43151653) is 2-cyclopropyl-2-(cyclopropylamino)propanenitrile.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)propanenitrile?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)propanenitrile is CC(C#N)(NC1CC1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)propanenitrile?
The InChIKey is ZZGFBIWQPXCYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-9(6-10,7-2-3-7)11-8-4-5-8/h7-8,11H,2-5H2,1H3.
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)propanenitrile?
2-cyclopropyl-2-(cyclopropylamino)propanenitrile has a molecular weight of 150.22 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)propanenitrile is sourced from PubChem (CID 43151653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).