1-(cyclobuten-1-yl)piperidine

C9H15N — CID 13447929

IUPAC1-(cyclobuten-1-yl)piperidine
SMILESC1=C(N2CCCCC2)CC1
InChIInChI=1S/C9H15N/c1-2-7-10(8-3-1)9-5-4-6-9/h5H,1-4,6-8H2
InChIKeyCDSXKHHHSPCYSK-UHFFFAOYSA-N
MW137.23 g/mol
LogP2.15
Rot. Bonds1

About 1-(cyclobuten-1-yl)piperidine

1-(cyclobuten-1-yl)piperidine (PubChem CID 13447929) has the molecular formula C9H15N and a molecular weight of 137.23 g/mol. Its IUPAC name is 1-(cyclobuten-1-yl)piperidine.

Molecular Properties

Compound Name1-(cyclobuten-1-yl)piperidine
PubChem CID13447929
Molecular FormulaC9H15N
Molecular Weight137.23 g/mol
Exact Mass137.12
IUPAC Name1-(cyclobuten-1-yl)piperidine
SMILESC1=C(N2CCCCC2)CC1
InChIInChI=1S/C9H15N/c1-2-7-10(8-3-1)9-5-4-6-9/h5H,1-4,6-8H2
InChIKeyCDSXKHHHSPCYSK-UHFFFAOYSA-N
XLogP2.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.23
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(cyclobuten-1-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

Piperidine, 1-(1-cyclopenten-1-yl)-
CID 137114
9(10)-Dehydroquinolizidine
CID 192825
3-Piperidino-2-pentene
CID 5372437
1-Methyl-2-methylenepiperidine
CID 20522178
1-Pent-2-en-3-ylpiperidine
CID 140804
1-[(E)-hept-3-en-4-yl]piperidine
CID 10397423
1-[(Z)-pent-2-en-3-yl]piperidine
CID 11094835
2,3,5,6,7,8-Hexahydroindolizine
CID 12842031
1-[(E)-hex-3-en-3-yl]piperidine
CID 13700162
1-[(E)-but-2-en-2-yl]piperidine
CID 20221266
1-But-1-en-2-ylpiperidine
CID 20715115
1-[(Z)-hept-3-en-4-yl]piperidine
CID 21499132

Frequently Asked Questions

What is the IUPAC name of 1-(cyclobuten-1-yl)piperidine?
The IUPAC name of 1-(cyclobuten-1-yl)piperidine (CID 13447929) is 1-(cyclobuten-1-yl)piperidine.
What is the SMILES notation for 1-(cyclobuten-1-yl)piperidine?
The canonical SMILES for 1-(cyclobuten-1-yl)piperidine is C1=C(N2CCCCC2)CC1.
What is the InChIKey of 1-(cyclobuten-1-yl)piperidine?
The InChIKey is CDSXKHHHSPCYSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N/c1-2-7-10(8-3-1)9-5-4-6-9/h5H,1-4,6-8H2.
What are the key properties of 1-(cyclobuten-1-yl)piperidine?
1-(cyclobuten-1-yl)piperidine has a molecular weight of 137.23 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobuten-1-yl)piperidine is sourced from PubChem (CID 13447929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).