1-(methylamino)cyclopentane-1-carbonitrile

C7H12N2 — CID 12945445

IUPAC1-(methylamino)cyclopentane-1-carbonitrile
SMILESCNC1(C#N)CCCC1
InChIInChI=1S/C7H12N2/c1-9-7(6-8)4-2-3-5-7/h9H,2-5H2,1H3
InChIKeyKNIPASVZFLFVSD-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.04
Rot. Bonds1

About 1-(methylamino)cyclopentane-1-carbonitrile

1-(methylamino)cyclopentane-1-carbonitrile (PubChem CID 12945445) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 1-(methylamino)cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-(methylamino)cyclopentane-1-carbonitrile
PubChem CID12945445
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name1-(methylamino)cyclopentane-1-carbonitrile
SMILESCNC1(C#N)CCCC1
InChIInChI=1S/C7H12N2/c1-9-7(6-8)4-2-3-5-7/h9H,2-5H2,1H3
InChIKeyKNIPASVZFLFVSD-UHFFFAOYSA-N
XLogP1.04
TPSA35.82 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(Methylamino)cyclohexane-1-carbonitrile
CID 94865
2-(Methylamino)cyclopentane-1-carbonitrile
CID 62742749
2-Methyl-1-(methylamino)cyclopentanecarbonitrile
CID 65045167
N,1-dimethylcyclopentan-1-amine
CID 19893816
1-(3-Fluoropropylamino)cyclopentane-1-carbonitrile
CID 89782516
1-((2-Fluoroethyl)amino)cyclopentanecarbonitrile
CID 89782688
1-Ethylamino-cyclopentanecarbonitrile
CID 21678969
2-[1-(Methylamino)cyclopentyl]acetonitrile
CID 10486915
1-(Tert-butylamino)cyclopentane-1-carbonitrile
CID 20825324
1-(Propan-2-ylamino)cyclopentane-1-carbonitrile
CID 28702656
1-(Isobutylamino)cyclopentanecarbonitrile
CID 28702664
1-(Pentylamino)cyclopentane-1-carbonitrile
CID 28702720

Frequently Asked Questions

What is the IUPAC name of 1-(methylamino)cyclopentane-1-carbonitrile?
The IUPAC name of 1-(methylamino)cyclopentane-1-carbonitrile (CID 12945445) is 1-(methylamino)cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-(methylamino)cyclopentane-1-carbonitrile?
The canonical SMILES for 1-(methylamino)cyclopentane-1-carbonitrile is CNC1(C#N)CCCC1.
What is the InChIKey of 1-(methylamino)cyclopentane-1-carbonitrile?
The InChIKey is KNIPASVZFLFVSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-9-7(6-8)4-2-3-5-7/h9H,2-5H2,1H3.
What are the key properties of 1-(methylamino)cyclopentane-1-carbonitrile?
1-(methylamino)cyclopentane-1-carbonitrile has a molecular weight of 124.19 g/mol, XLogP of 1.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylamino)cyclopentane-1-carbonitrile is sourced from PubChem (CID 12945445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).