1-methyl-4-xanthen-9-ylidenepiperidine

C19H19NO — CID 10039173

IUPAC1-methyl-4-xanthen-9-ylidenepiperidine
SMILESCN1CCC(=C2c3ccccc3Oc3ccccc32)CC1
InChIInChI=1S/C19H19NO/c1-20-12-10-14(11-13-20)19-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)19/h2-9H,10-13H2,1H3
InChIKeyCSKMXVOVYIXALX-UHFFFAOYSA-N
MW277.37 g/mol
LogP4.32
Rot. Bonds

About 1-methyl-4-xanthen-9-ylidenepiperidine

1-methyl-4-xanthen-9-ylidenepiperidine (PubChem CID 10039173) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-methyl-4-xanthen-9-ylidenepiperidine.

Molecular Properties

Compound Name1-methyl-4-xanthen-9-ylidenepiperidine
PubChem CID10039173
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC Name1-methyl-4-xanthen-9-ylidenepiperidine
SMILESCN1CCC(=C2c3ccccc3Oc3ccccc32)CC1
InChIInChI=1S/C19H19NO/c1-20-12-10-14(11-13-20)19-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)19/h2-9H,10-13H2,1H3
InChIKeyCSKMXVOVYIXALX-UHFFFAOYSA-N
XLogP4.32
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-xanthen-9-ylidenepiperidine?
The IUPAC name of 1-methyl-4-xanthen-9-ylidenepiperidine (CID 10039173) is 1-methyl-4-xanthen-9-ylidenepiperidine.
What is the SMILES notation for 1-methyl-4-xanthen-9-ylidenepiperidine?
The canonical SMILES for 1-methyl-4-xanthen-9-ylidenepiperidine is CN1CCC(=C2c3ccccc3Oc3ccccc32)CC1.
What is the InChIKey of 1-methyl-4-xanthen-9-ylidenepiperidine?
The InChIKey is CSKMXVOVYIXALX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-20-12-10-14(11-13-20)19-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)19/h2-9H,10-13H2,1H3.
What are the key properties of 1-methyl-4-xanthen-9-ylidenepiperidine?
1-methyl-4-xanthen-9-ylidenepiperidine has a molecular weight of 277.37 g/mol, XLogP of 4.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-xanthen-9-ylidenepiperidine is sourced from PubChem (CID 10039173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).