3-(cyclopropylmethoxy)piperidine

C9H17NO — CID 45075364

IUPAC3-(cyclopropylmethoxy)piperidine
SMILESC1CNCC(OCC2CC2)C1
InChIInChI=1S/C9H17NO/c1-2-9(6-10-5-1)11-7-8-3-4-8/h8-10H,1-7H2
InChIKeyYPTKIXGGEPCHDH-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.16
Rot. Bonds3

About 3-(cyclopropylmethoxy)piperidine

3-(cyclopropylmethoxy)piperidine (PubChem CID 45075364) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 3-(cyclopropylmethoxy)piperidine.

Molecular Properties

Compound Name3-(cyclopropylmethoxy)piperidine
PubChem CID45075364
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name3-(cyclopropylmethoxy)piperidine
SMILESC1CNCC(OCC2CC2)C1
InChIInChI=1S/C9H17NO/c1-2-9(6-10-5-1)11-7-8-3-4-8/h8-10H,1-7H2
InChIKeyYPTKIXGGEPCHDH-UHFFFAOYSA-N
XLogP1.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethoxy)piperidine?
The IUPAC name of 3-(cyclopropylmethoxy)piperidine (CID 45075364) is 3-(cyclopropylmethoxy)piperidine.
What is the SMILES notation for 3-(cyclopropylmethoxy)piperidine?
The canonical SMILES for 3-(cyclopropylmethoxy)piperidine is C1CNCC(OCC2CC2)C1.
What is the InChIKey of 3-(cyclopropylmethoxy)piperidine?
The InChIKey is YPTKIXGGEPCHDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-2-9(6-10-5-1)11-7-8-3-4-8/h8-10H,1-7H2.
What are the key properties of 3-(cyclopropylmethoxy)piperidine?
3-(cyclopropylmethoxy)piperidine has a molecular weight of 155.24 g/mol, XLogP of 1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethoxy)piperidine is sourced from PubChem (CID 45075364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).