1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine

C13H23NO — CID 102647213

IUPAC1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
SMILESCNC(C1=CCCCO1)C1CCCCC1
InChIInChI=1S/C13H23NO/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h9,11,13-14H,2-8,10H2,1H3
InChIKeyWCBUSYYMCPCQGN-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.85
Rot. Bonds3

About 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine

1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine (PubChem CID 102647213) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
PubChem CID102647213
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine
SMILESCNC(C1=CCCCO1)C1CCCCC1
InChIInChI=1S/C13H23NO/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h9,11,13-14H,2-8,10H2,1H3
InChIKeyWCBUSYYMCPCQGN-UHFFFAOYSA-N
XLogP2.85
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
The IUPAC name of 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine (CID 102647213) is 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine.
What is the SMILES notation for 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
The canonical SMILES for 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine is CNC(C1=CCCCO1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
The InChIKey is WCBUSYYMCPCQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c1-14-13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h9,11,13-14H,2-8,10H2,1H3.
What are the key properties of 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine?
1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine has a molecular weight of 209.33 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-(3,4-dihydro-2H-pyran-6-yl)-N-methylmethanamine is sourced from PubChem (CID 102647213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).