N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine

C10H17N — CID 66806733

IUPACN-ethenyl-4,6-dimethylcyclohex-3-en-1-amine
SMILESC=CNC1CC=C(C)CC1C
InChIInChI=1S/C10H17N/c1-4-11-10-6-5-8(2)7-9(10)3/h4-5,9-11H,1,6-7H2,2-3H3
InChIKeyXGNSRDZJQGWLST-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.46
Rot. Bonds2

About N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine

N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine (PubChem CID 66806733) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine.

Molecular Properties

Compound NameN-ethenyl-4,6-dimethylcyclohex-3-en-1-amine
PubChem CID66806733
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN-ethenyl-4,6-dimethylcyclohex-3-en-1-amine
SMILESC=CNC1CC=C(C)CC1C
InChIInChI=1S/C10H17N/c1-4-11-10-6-5-8(2)7-9(10)3/h4-5,9-11H,1,6-7H2,2-3H3
InChIKeyXGNSRDZJQGWLST-UHFFFAOYSA-N
XLogP2.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine?
The IUPAC name of N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine (CID 66806733) is N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine.
What is the SMILES notation for N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine?
The canonical SMILES for N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine is C=CNC1CC=C(C)CC1C.
What is the InChIKey of N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine?
The InChIKey is XGNSRDZJQGWLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-4-11-10-6-5-8(2)7-9(10)3/h4-5,9-11H,1,6-7H2,2-3H3.
What are the key properties of N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine?
N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-4,6-dimethylcyclohex-3-en-1-amine is sourced from PubChem (CID 66806733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).