2-methylcyclopentan-1-imine

C6H11N — CID 10240765

IUPAC2-methylcyclopentan-1-imine
SMILES[H]/N=C1\CCCC1C
InChIInChI=1S/C6H11N/c1-5-3-2-4-6(5)7/h5,7H,2-4H2,1H3/b7-6+
InChIKeySWQXMDOLWXHAIJ-VOTSOKGWSA-N
MW97.16 g/mol
LogP1.83
Rot. Bonds

About 2-methylcyclopentan-1-imine

2-methylcyclopentan-1-imine (PubChem CID 10240765) has the molecular formula C6H11N and a molecular weight of 97.16 g/mol. Its IUPAC name is 2-methylcyclopentan-1-imine.

Molecular Properties

Compound Name2-methylcyclopentan-1-imine
PubChem CID10240765
Molecular FormulaC6H11N
Molecular Weight97.16 g/mol
Exact Mass97.09
IUPAC Name2-methylcyclopentan-1-imine
SMILES[H]/N=C1\CCCC1C
InChIInChI=1S/C6H11N/c1-5-3-2-4-6(5)7/h5,7H,2-4H2,1H3/b7-6+
InChIKeySWQXMDOLWXHAIJ-VOTSOKGWSA-N
XLogP1.83
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.16
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-Methylpentan-2-imine
CID 18426397
2,4-Dimethylpentan-3-imine
CID 20560155
1-[(1S)-3,3-difluorocyclopentyl]ethanimine
CID 144713079
CID 146166386
CID 146166386
1-(3,3-Difluorocyclopentyl)ethanimine
CID 169169649
1-Cyclopentylethanimine
CID 18727540
5-Methylhexan-3-imine
CID 20811319
4-Methylhexan-2-imine
CID 21943615
5-Methylhexan-2-imine
CID 23163176
3-Methylpentan-2-imine
CID 53663690
2-Methylpentan-3-imine
CID 54130897
(2R)-2-methylcyclopentan-1-imine
CID 54134459

Frequently Asked Questions

What is the IUPAC name of 2-methylcyclopentan-1-imine?
The IUPAC name of 2-methylcyclopentan-1-imine (CID 10240765) is 2-methylcyclopentan-1-imine.
What is the SMILES notation for 2-methylcyclopentan-1-imine?
The canonical SMILES for 2-methylcyclopentan-1-imine is [H]/N=C1\CCCC1C.
What is the InChIKey of 2-methylcyclopentan-1-imine?
The InChIKey is SWQXMDOLWXHAIJ-VOTSOKGWSA-N. The full InChI is InChI=1S/C6H11N/c1-5-3-2-4-6(5)7/h5,7H,2-4H2,1H3/b7-6+.
What are the key properties of 2-methylcyclopentan-1-imine?
2-methylcyclopentan-1-imine has a molecular weight of 97.16 g/mol, XLogP of 1.83, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylcyclopentan-1-imine is sourced from PubChem (CID 10240765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).