1-(cyclopentylamino)cyclopentane-1-carbonitrile

C11H18N2 — CID 28702667

IUPAC1-(cyclopentylamino)cyclopentane-1-carbonitrile
SMILESN#CC1(NC2CCCC2)CCCC1
InChIInChI=1S/C11H18N2/c12-9-11(7-3-4-8-11)13-10-5-1-2-6-10/h10,13H,1-8H2
InChIKeyVNSBABMPJFUDNQ-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.35
Rot. Bonds2

About 1-(cyclopentylamino)cyclopentane-1-carbonitrile

1-(cyclopentylamino)cyclopentane-1-carbonitrile (PubChem CID 28702667) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 1-(cyclopentylamino)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-(cyclopentylamino)cyclopentane-1-carbonitrile
PubChem CID28702667
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name1-(cyclopentylamino)cyclopentane-1-carbonitrile
SMILESN#CC1(NC2CCCC2)CCCC1
InChIInChI=1S/C11H18N2/c12-9-11(7-3-4-8-11)13-10-5-1-2-6-10/h10,13H,1-8H2
InChIKeyVNSBABMPJFUDNQ-UHFFFAOYSA-N
XLogP2.35
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylamino)cyclopentane-1-carbonitrile?
The IUPAC name of 1-(cyclopentylamino)cyclopentane-1-carbonitrile (CID 28702667) is 1-(cyclopentylamino)cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-(cyclopentylamino)cyclopentane-1-carbonitrile?
The canonical SMILES for 1-(cyclopentylamino)cyclopentane-1-carbonitrile is N#CC1(NC2CCCC2)CCCC1.
What is the InChIKey of 1-(cyclopentylamino)cyclopentane-1-carbonitrile?
The InChIKey is VNSBABMPJFUDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c12-9-11(7-3-4-8-11)13-10-5-1-2-6-10/h10,13H,1-8H2.
What are the key properties of 1-(cyclopentylamino)cyclopentane-1-carbonitrile?
1-(cyclopentylamino)cyclopentane-1-carbonitrile has a molecular weight of 178.28 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylamino)cyclopentane-1-carbonitrile is sourced from PubChem (CID 28702667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).