2-decyl-3-iminocyclopropen-1-amine

C13H24N2 — CID 59755487

IUPAC2-decyl-3-iminocyclopropen-1-amine
SMILES[H]/N=c1/c(N)c1CCCCCCCCCC
InChIInChI=1S/C13H24N2/c1-2-3-4-5-6-7-8-9-10-11-12(14)13(11)15/h14H,2-10,15H2,1H3/b14-12+
InChIKeyCRYNVZREGUZPSS-WYMLVPIESA-N
MW208.35 g/mol
LogP3.31
Rot. Bonds9

About 2-decyl-3-iminocyclopropen-1-amine

2-decyl-3-iminocyclopropen-1-amine (PubChem CID 59755487) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 2-decyl-3-iminocyclopropen-1-amine.

Molecular Properties

Compound Name2-decyl-3-iminocyclopropen-1-amine
PubChem CID59755487
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name2-decyl-3-iminocyclopropen-1-amine
SMILES[H]/N=c1/c(N)c1CCCCCCCCCC
InChIInChI=1S/C13H24N2/c1-2-3-4-5-6-7-8-9-10-11-12(14)13(11)15/h14H,2-10,15H2,1H3/b14-12+
InChIKeyCRYNVZREGUZPSS-WYMLVPIESA-N
XLogP3.31
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-decyl-3-iminocyclopropen-1-amine?
The IUPAC name of 2-decyl-3-iminocyclopropen-1-amine (CID 59755487) is 2-decyl-3-iminocyclopropen-1-amine.
What is the SMILES notation for 2-decyl-3-iminocyclopropen-1-amine?
The canonical SMILES for 2-decyl-3-iminocyclopropen-1-amine is [H]/N=c1/c(N)c1CCCCCCCCCC.
What is the InChIKey of 2-decyl-3-iminocyclopropen-1-amine?
The InChIKey is CRYNVZREGUZPSS-WYMLVPIESA-N. The full InChI is InChI=1S/C13H24N2/c1-2-3-4-5-6-7-8-9-10-11-12(14)13(11)15/h14H,2-10,15H2,1H3/b14-12+.
What are the key properties of 2-decyl-3-iminocyclopropen-1-amine?
2-decyl-3-iminocyclopropen-1-amine has a molecular weight of 208.35 g/mol, XLogP of 3.31, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-decyl-3-iminocyclopropen-1-amine is sourced from PubChem (CID 59755487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).