1-(3,6-dihydro-2H-pyran-2-yl)piperidine

C10H17NO — CID 90897325

IUPAC1-(3,6-dihydro-2H-pyran-2-yl)piperidine
SMILESC1=CCC(N2CCCCC2)OC1
InChIInChI=1S/C10H17NO/c1-3-7-11(8-4-1)10-6-2-5-9-12-10/h2,5,10H,1,3-4,6-9H2
InChIKeyOFVHDSANNAFITA-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.77
Rot. Bonds1

About 1-(3,6-dihydro-2H-pyran-2-yl)piperidine

1-(3,6-dihydro-2H-pyran-2-yl)piperidine (PubChem CID 90897325) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 1-(3,6-dihydro-2H-pyran-2-yl)piperidine.

Molecular Properties

Compound Name1-(3,6-dihydro-2H-pyran-2-yl)piperidine
PubChem CID90897325
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name1-(3,6-dihydro-2H-pyran-2-yl)piperidine
SMILESC1=CCC(N2CCCCC2)OC1
InChIInChI=1S/C10H17NO/c1-3-7-11(8-4-1)10-6-2-5-9-12-10/h2,5,10H,1,3-4,6-9H2
InChIKeyOFVHDSANNAFITA-UHFFFAOYSA-N
XLogP1.77
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(3,6-dihydro-2H-pyran-2-yl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-Cyclohexa-2,5-dien-1-yloxypropyl)piperidine
CID 57115460
4-(2-Methoxyethylidene)-1-methylpiperidine
CID 59255536
N,N-bis(prop-2-enyl)-3,6-dihydro-2H-pyran-2-amine
CID 67907519
Ethane;4-(2-methoxyethylidene)-1-methylpiperidine
CID 143832103
1-(3,6-Dihydro-2H-pyran-4-yl)piperidine
CID 13616700

Frequently Asked Questions

What is the IUPAC name of 1-(3,6-dihydro-2H-pyran-2-yl)piperidine?
The IUPAC name of 1-(3,6-dihydro-2H-pyran-2-yl)piperidine (CID 90897325) is 1-(3,6-dihydro-2H-pyran-2-yl)piperidine.
What is the SMILES notation for 1-(3,6-dihydro-2H-pyran-2-yl)piperidine?
The canonical SMILES for 1-(3,6-dihydro-2H-pyran-2-yl)piperidine is C1=CCC(N2CCCCC2)OC1.
What is the InChIKey of 1-(3,6-dihydro-2H-pyran-2-yl)piperidine?
The InChIKey is OFVHDSANNAFITA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-3-7-11(8-4-1)10-6-2-5-9-12-10/h2,5,10H,1,3-4,6-9H2.
What are the key properties of 1-(3,6-dihydro-2H-pyran-2-yl)piperidine?
1-(3,6-dihydro-2H-pyran-2-yl)piperidine has a molecular weight of 167.25 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,6-dihydro-2H-pyran-2-yl)piperidine is sourced from PubChem (CID 90897325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).