1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile

C11H18N2 — CID 64513094

IUPAC1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile
SMILESCCC1CCC(C#N)(NC2CC2)C1
InChIInChI=1S/C11H18N2/c1-2-9-5-6-11(7-9,8-12)13-10-3-4-10/h9-10,13H,2-7H2,1H3
InChIKeyFJBSMDWPZFWZNG-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.21
Rot. Bonds3

About 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile

1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile (PubChem CID 64513094) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile
PubChem CID64513094
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile
SMILESCCC1CCC(C#N)(NC2CC2)C1
InChIInChI=1S/C11H18N2/c1-2-9-5-6-11(7-9,8-12)13-10-3-4-10/h9-10,13H,2-7H2,1H3
InChIKeyFJBSMDWPZFWZNG-UHFFFAOYSA-N
XLogP2.21
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile 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

1-(cycloheptylamino)-4-ethylcycloheptane-1-carbonitrile
CID 65088445
1-(cyclopropylamino)-3-[cyclopropylmethyl(ethyl)amino]cyclopentane-1-carbonitrile
CID 79639178
1-(cyclopropylamino)-3-[ethyl(methyl)amino]cyclopentane-1-carbonitrile
CID 79639654
4-ethyl-1-(methylamino)cyclohexane-1-carbonitrile
CID 43115038
N-(1-cyano-4-ethylcyclohexyl)acetamide
CID 61120751
3-(cyclohexylmethoxy)-1-(cyclopropylamino)cyclopentane-1-carbonitrile
CID 79650525
1-(cycloheptylamino)-4-propylcycloheptane-1-carbonitrile
CID 65089014
1-(cyclopropylamino)-3-[(1-ethylpiperidin-4-yl)-methylamino]cyclopentane-1-carbonitrile
CID 79639992
1-(cyclopropylamino)-3-(3,3-dimethylbutoxy)cyclopentane-1-carbonitrile
CID 79649738
1-(cyclopropylamino)-3-(3-ethylmorpholin-4-yl)cyclopentane-1-carbonitrile
CID 79638552
1-(butan-2-ylamino)-4-ethylcyclohexane-1-carbonitrile
CID 61023499
1-(cyclopropylamino)-3-[cyclopropylmethyl(propyl)amino]cyclohexane-1-carbonitrile
CID 79625729

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile?
The IUPAC name of 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile (CID 64513094) is 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile.
What is the SMILES notation for 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile?
The canonical SMILES for 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile is CCC1CCC(C#N)(NC2CC2)C1.
What is the InChIKey of 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile?
The InChIKey is FJBSMDWPZFWZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-2-9-5-6-11(7-9,8-12)13-10-3-4-10/h9-10,13H,2-7H2,1H3.
What are the key properties of 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile?
1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile has a molecular weight of 178.28 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-3-ethylcyclopentane-1-carbonitrile is sourced from PubChem (CID 64513094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).