1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine

C13H23NO — CID 106654422

IUPAC1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine
SMILESCNC(C1=CCCCC1)C1(OC)CCC1
InChIInChI=1S/C13H23NO/c1-14-12(11-7-4-3-5-8-11)13(15-2)9-6-10-13/h7,12,14H,3-6,8-10H2,1-2H3
InChIKeyCYLXRUWEJQMFTA-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.64
Rot. Bonds4

About 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine

1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine (PubChem CID 106654422) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine
PubChem CID106654422
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine
SMILESCNC(C1=CCCCC1)C1(OC)CCC1
InChIInChI=1S/C13H23NO/c1-14-12(11-7-4-3-5-8-11)13(15-2)9-6-10-13/h7,12,14H,3-6,8-10H2,1-2H3
InChIKeyCYLXRUWEJQMFTA-UHFFFAOYSA-N
XLogP2.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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

[cycloocten-1-yl-(1-methoxycycloheptyl)methyl]hydrazine
CID 106649647
1-(cyclohexen-1-yl)-1-(1-ethoxy-4-methylcyclohexyl)-N-methylmethanamine
CID 106654643
1-(cyclohepten-1-yl)-1-(1-ethoxy-3-methylcyclohexyl)-N-methylmethanamine
CID 106654657
1-(cyclohexen-1-yl)-N-methyl-1-(1-methylcyclohexyl)methanamine
CID 106827010
N-[cyclohexen-1-yl-(1-methoxy-4,4-dimethylcyclohexyl)methyl]propan-1-amine
CID 106654677
N-[cyclohexen-1-yl-(1-ethoxycyclohexyl)methyl]propan-1-amine
CID 106654605
1-(1-methoxycyclobutyl)-N-methyl-1-thiophen-2-ylmethanamine
CID 116714360
cyclohepten-1-yl-(4-methoxyoxan-4-yl)methanamine
CID 106654606
1-(cyclohexen-1-yl)-2-methoxy-N-methylethanamine
CID 106652673
1-(cycloocten-1-yl)-N-methylethanamine
CID 106652570
[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine
CID 106649341
[cyclohexen-1-yl-(1-ethoxy-3-methylcyclohexyl)methyl]hydrazine
CID 106649638

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine?
The IUPAC name of 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine (CID 106654422) is 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine.
What is the SMILES notation for 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine?
The canonical SMILES for 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine is CNC(C1=CCCCC1)C1(OC)CCC1.
What is the InChIKey of 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine?
The InChIKey is CYLXRUWEJQMFTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-14-12(11-7-4-3-5-8-11)13(15-2)9-6-10-13/h7,12,14H,3-6,8-10H2,1-2H3.
What are the key properties of 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine?
1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine has a molecular weight of 209.33 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexen-1-yl)-1-(1-methoxycyclobutyl)-N-methylmethanamine is sourced from PubChem (CID 106654422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).