(3R,5R)-3-methoxy-5-propan-2-ylpiperidine

C9H19NO — CID 139339698

IUPAC(3R,5R)-3-methoxy-5-propan-2-ylpiperidine
SMILESCO[C@H]1CNC[C@@H](C(C)C)C1
InChIInChI=1S/C9H19NO/c1-7(2)8-4-9(11-3)6-10-5-8/h7-10H,4-6H2,1-3H3/t8-,9+/m0/s1
InChIKeyFHYNVIHFNWKLCN-DTWKUNHWSA-N
MW157.26 g/mol
LogP1.27
Rot. Bonds2

About (3R,5R)-3-methoxy-5-propan-2-ylpiperidine

(3R,5R)-3-methoxy-5-propan-2-ylpiperidine (PubChem CID 139339698) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (3R,5R)-3-methoxy-5-propan-2-ylpiperidine.

Molecular Properties

Compound Name(3R,5R)-3-methoxy-5-propan-2-ylpiperidine
PubChem CID139339698
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(3R,5R)-3-methoxy-5-propan-2-ylpiperidine
SMILESCO[C@H]1CNC[C@@H](C(C)C)C1
InChIInChI=1S/C9H19NO/c1-7(2)8-4-9(11-3)6-10-5-8/h7-10H,4-6H2,1-3H3/t8-,9+/m0/s1
InChIKeyFHYNVIHFNWKLCN-DTWKUNHWSA-N
XLogP1.27
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R,5R)-3-methoxy-5-propan-2-ylpiperidine?
The IUPAC name of (3R,5R)-3-methoxy-5-propan-2-ylpiperidine (CID 139339698) is (3R,5R)-3-methoxy-5-propan-2-ylpiperidine.
What is the SMILES notation for (3R,5R)-3-methoxy-5-propan-2-ylpiperidine?
The canonical SMILES for (3R,5R)-3-methoxy-5-propan-2-ylpiperidine is CO[C@H]1CNC[C@@H](C(C)C)C1.
What is the InChIKey of (3R,5R)-3-methoxy-5-propan-2-ylpiperidine?
The InChIKey is FHYNVIHFNWKLCN-DTWKUNHWSA-N. The full InChI is InChI=1S/C9H19NO/c1-7(2)8-4-9(11-3)6-10-5-8/h7-10H,4-6H2,1-3H3/t8-,9+/m0/s1.
What are the key properties of (3R,5R)-3-methoxy-5-propan-2-ylpiperidine?
(3R,5R)-3-methoxy-5-propan-2-ylpiperidine has a molecular weight of 157.26 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-3-methoxy-5-propan-2-ylpiperidine is sourced from PubChem (CID 139339698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).