N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine

C13H23NO — CID 115908359

IUPACN-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine
SMILESCC1CC(NC2C=CCCC2)CC(C)O1
InChIInChI=1S/C13H23NO/c1-10-8-13(9-11(2)15-10)14-12-6-4-3-5-7-12/h4,6,10-14H,3,5,7-9H2,1-2H3
InChIKeyRWALNXGUCVYTLJ-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.64
Rot. Bonds2

About N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine

N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine (PubChem CID 115908359) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine.

Molecular Properties

Compound NameN-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine
PubChem CID115908359
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC NameN-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine
SMILESCC1CC(NC2C=CCCC2)CC(C)O1
InChIInChI=1S/C13H23NO/c1-10-8-13(9-11(2)15-10)14-12-6-4-3-5-7-12/h4,6,10-14H,3,5,7-9H2,1-2H3
InChIKeyRWALNXGUCVYTLJ-UHFFFAOYSA-N
XLogP2.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[3,4-dihydro-2H-pyran-6-yl(fluoro)methyl]piperidine
CID 106634971
(2S,4S)-2-[(E)-pent-3-enyl]piperidin-4-ol
CID 11446566
3-Pentoxy-8-azabicyclo[3.2.1]oct-6-ene
CID 69091731
N-(3-methoxypropyl)cyclohex-2-en-1-amine
CID 107906534
1-(6-piperidin-4-yloxyhexyl)-3,6-dihydro-2H-pyridine
CID 141050421
5-methoxy-N-methylcyclohex-2-en-1-amine
CID 144521544
N-methyl-3-propan-2-yloxycyclohex-3-en-1-amine
CID 163703648
ethane;N-(4-methylcyclohex-3-en-1-yl)oxan-4-amine
CID 177317206
N-(3-methylcyclohex-2-en-1-yl)oxan-4-amine
CID 177317433
N-[2-(cyclohex-1-en-1-yl)ethyl]oxan-4-amine
CID 43608459
N-[cyclohexen-1-yl(oxan-2-yl)methyl]propan-1-amine
CID 55048190
N-[cyclohexen-1-yl(oxan-2-yl)methyl]ethanamine
CID 62212634

Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine?
The IUPAC name of N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine (CID 115908359) is N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine.
What is the SMILES notation for N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine?
The canonical SMILES for N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine is CC1CC(NC2C=CCCC2)CC(C)O1.
What is the InChIKey of N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine?
The InChIKey is RWALNXGUCVYTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-10-8-13(9-11(2)15-10)14-12-6-4-3-5-7-12/h4,6,10-14H,3,5,7-9H2,1-2H3.
What are the key properties of N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine?
N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine has a molecular weight of 209.33 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-yl-2,6-dimethyloxan-4-amine is sourced from PubChem (CID 115908359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).