2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile

C12H22N2 — CID 130637119

IUPAC2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile
SMILESCC(C)(C#N)NC(C)(C)C1CCCC1
InChIInChI=1S/C12H22N2/c1-11(2,9-13)14-12(3,4)10-7-5-6-8-10/h10,14H,5-8H2,1-4H3
InChIKeyJLBYKPMXCZFAHQ-UHFFFAOYSA-N
MW194.32 g/mol
LogP2.85
Rot. Bonds3

About 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile

2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile (PubChem CID 130637119) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile.

Molecular Properties

Compound Name2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile
PubChem CID130637119
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile
SMILESCC(C)(C#N)NC(C)(C)C1CCCC1
InChIInChI=1S/C12H22N2/c1-11(2,9-13)14-12(3,4)10-7-5-6-8-10/h10,14H,5-8H2,1-4H3
InChIKeyJLBYKPMXCZFAHQ-UHFFFAOYSA-N
XLogP2.85
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyanopropan-2-yl)bicyclo[4.1.0]heptane-7-carboxamide
CID 79209192
2-chloro-2,2-di(cyclobutyl)acetonitrile
CID 130529061
2-cyclobutyl-2-methylbutanenitrile
CID 90137843
2-(cyclopropylmethylamino)-2-methylpropanenitrile
CID 60995083
N-(2-cyclopropylpropan-2-yl)cyclopentanamine
CID 103923045
2-cyclohexyl-2-(3-hydroxypropylamino)propanenitrile
CID 62586794
tert-butylcyclopentadecane
CID 164774831
2-cyclopropyl-N-methylpropan-2-amine
CID 82593557
tert-butylcyclopentane;tert-butylcyclopropane
CID 160905619
(2R)-2-amino-2-cyclohexylbutanenitrile
CID 67737237
2-(benzylamino)-2-cyclopentylpropanenitrile
CID 55096722
2-(4-chloroanilino)-2-cyclohexylpropanenitrile
CID 54886371

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile?
The IUPAC name of 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile (CID 130637119) is 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile.
What is the SMILES notation for 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile?
The canonical SMILES for 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile is CC(C)(C#N)NC(C)(C)C1CCCC1.
What is the InChIKey of 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile?
The InChIKey is JLBYKPMXCZFAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-11(2,9-13)14-12(3,4)10-7-5-6-8-10/h10,14H,5-8H2,1-4H3.
What are the key properties of 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile?
2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile has a molecular weight of 194.32 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentylpropan-2-ylamino)-2-methylpropanenitrile is sourced from PubChem (CID 130637119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).