(2-iminocyclopentyl)methanamine

C6H12N2 — CID 91322509

IUPAC(2-iminocyclopentyl)methanamine
SMILES[H]/N=C1\CCCC1CN
InChIInChI=1S/C6H12N2/c7-4-5-2-1-3-6(5)8/h5,8H,1-4,7H2/b8-6+
InChIKeyXOYXAUFGFQPNIP-SOFGYWHQSA-N
MW112.18 g/mol
LogP0.76
Rot. Bonds1

About (2-iminocyclopentyl)methanamine

(2-iminocyclopentyl)methanamine (PubChem CID 91322509) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is (2-iminocyclopentyl)methanamine.

Molecular Properties

Compound Name(2-iminocyclopentyl)methanamine
PubChem CID91322509
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name(2-iminocyclopentyl)methanamine
SMILES[H]/N=C1\CCCC1CN
InChIInChI=1S/C6H12N2/c7-4-5-2-1-3-6(5)8/h5,8H,1-4,7H2/b8-6+
InChIKeyXOYXAUFGFQPNIP-SOFGYWHQSA-N
XLogP0.76
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2-iminocyclopropyl)methanamine
CID 160659278
2-iminocyclohexan-1-amine
CID 23599757
2-iminocyclopentan-1-ol
CID 131743641
bicyclo[4.2.0]octan-2-imine
CID 142909528
2-(aminomethyl)cycloheptan-1-one
CID 84731152
[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]methanamine;hydrochloride
CID 171991657
trimethyl-[[(1R)-2-oxocyclopentyl]methyl]azanium iodide
CID 53298307
ethyl 2-iminocyclohexane-1-carboxylate
CID 57207114
(1R)-2-iminocyclohexane-1-carboxylic acid
CID 86316627
8-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-ol
CID 83827745
(2,4-dimethyl-5,6,7,8-tetrahydroquinazolin-5-yl)methanamine
CID 83861961
N'-diazenyl-2-imino-2-(2-iminocyclopentyl)ethanimidamide
CID 137139753

Frequently Asked Questions

What is the IUPAC name of (2-iminocyclopentyl)methanamine?
The IUPAC name of (2-iminocyclopentyl)methanamine (CID 91322509) is (2-iminocyclopentyl)methanamine.
What is the SMILES notation for (2-iminocyclopentyl)methanamine?
The canonical SMILES for (2-iminocyclopentyl)methanamine is [H]/N=C1\CCCC1CN.
What is the InChIKey of (2-iminocyclopentyl)methanamine?
The InChIKey is XOYXAUFGFQPNIP-SOFGYWHQSA-N. The full InChI is InChI=1S/C6H12N2/c7-4-5-2-1-3-6(5)8/h5,8H,1-4,7H2/b8-6+.
What are the key properties of (2-iminocyclopentyl)methanamine?
(2-iminocyclopentyl)methanamine has a molecular weight of 112.18 g/mol, XLogP of 0.76, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-iminocyclopentyl)methanamine is sourced from PubChem (CID 91322509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).