N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine

C14H26N2 — CID 83007604

IUPACN-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine
SMILESCC1CCCC(C)N1NCC1CC=CCC1
InChIInChI=1S/C14H26N2/c1-12-7-6-8-13(2)16(12)15-11-14-9-4-3-5-10-14/h3-4,12-15H,5-11H2,1-2H3
InChIKeyNDZNJCUVOIWHND-UHFFFAOYSA-N
MW222.38 g/mol
LogP3.11
Rot. Bonds3

About N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine

N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine (PubChem CID 83007604) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine
PubChem CID83007604
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC NameN-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine
SMILESCC1CCCC(C)N1NCC1CC=CCC1
InChIInChI=1S/C14H26N2/c1-12-7-6-8-13(2)16(12)15-11-14-9-4-3-5-10-14/h3-4,12-15H,5-11H2,1-2H3
InChIKeyNDZNJCUVOIWHND-UHFFFAOYSA-N
XLogP3.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine (CID 83007604) is N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine is CC1CCCC(C)N1NCC1CC=CCC1.
What is the InChIKey of N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine?
The InChIKey is NDZNJCUVOIWHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-12-7-6-8-13(2)16(12)15-11-14-9-4-3-5-10-14/h3-4,12-15H,5-11H2,1-2H3.
What are the key properties of N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine?
N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine has a molecular weight of 222.38 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohex-3-en-1-ylmethyl)-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83007604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).