4-methoxy-4-methyl-1-propan-2-ylpiperidine

C10H21NO — CID 67477357

IUPAC4-methoxy-4-methyl-1-propan-2-ylpiperidine
SMILESCOC1(C)CCN(C(C)C)CC1
InChIInChI=1S/C10H21NO/c1-9(2)11-7-5-10(3,12-4)6-8-11/h9H,5-8H2,1-4H3
InChIKeyRCJIGFGAVCAVJV-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.90
Rot. Bonds2

About 4-methoxy-4-methyl-1-propan-2-ylpiperidine

4-methoxy-4-methyl-1-propan-2-ylpiperidine (PubChem CID 67477357) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-methoxy-4-methyl-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-methoxy-4-methyl-1-propan-2-ylpiperidine
PubChem CID67477357
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-methoxy-4-methyl-1-propan-2-ylpiperidine
SMILESCOC1(C)CCN(C(C)C)CC1
InChIInChI=1S/C10H21NO/c1-9(2)11-7-5-10(3,12-4)6-8-11/h9H,5-8H2,1-4H3
InChIKeyRCJIGFGAVCAVJV-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-1-propan-2-ylpiperidine?
The IUPAC name of 4-methoxy-4-methyl-1-propan-2-ylpiperidine (CID 67477357) is 4-methoxy-4-methyl-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-methoxy-4-methyl-1-propan-2-ylpiperidine?
The canonical SMILES for 4-methoxy-4-methyl-1-propan-2-ylpiperidine is COC1(C)CCN(C(C)C)CC1.
What is the InChIKey of 4-methoxy-4-methyl-1-propan-2-ylpiperidine?
The InChIKey is RCJIGFGAVCAVJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2)11-7-5-10(3,12-4)6-8-11/h9H,5-8H2,1-4H3.
What are the key properties of 4-methoxy-4-methyl-1-propan-2-ylpiperidine?
4-methoxy-4-methyl-1-propan-2-ylpiperidine has a molecular weight of 171.28 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-methyl-1-propan-2-ylpiperidine is sourced from PubChem (CID 67477357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).