(2R,4R)-2-methyl-4-propan-2-ylpiperidine

C9H19N — CID 96733113

IUPAC(2R,4R)-2-methyl-4-propan-2-ylpiperidine
SMILESCC(C)[C@@H]1CCN[C@H](C)C1
InChIInChI=1S/C9H19N/c1-7(2)9-4-5-10-8(3)6-9/h7-10H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKeyFYMWCRNFTFSZBO-RKDXNWHRSA-N
MW141.26 g/mol
LogP2.03
Rot. Bonds1

About (2R,4R)-2-methyl-4-propan-2-ylpiperidine

(2R,4R)-2-methyl-4-propan-2-ylpiperidine (PubChem CID 96733113) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (2R,4R)-2-methyl-4-propan-2-ylpiperidine.

Molecular Properties

Compound Name(2R,4R)-2-methyl-4-propan-2-ylpiperidine
PubChem CID96733113
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(2R,4R)-2-methyl-4-propan-2-ylpiperidine
SMILESCC(C)[C@@H]1CCN[C@H](C)C1
InChIInChI=1S/C9H19N/c1-7(2)9-4-5-10-8(3)6-9/h7-10H,4-6H2,1-3H3/t8-,9-/m1/s1
InChIKeyFYMWCRNFTFSZBO-RKDXNWHRSA-N
XLogP2.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2R,4R)-2-methyl-4-propan-2-ylpiperidine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R,4R)-2-methyl-4-propan-2-ylpiperidine?
The IUPAC name of (2R,4R)-2-methyl-4-propan-2-ylpiperidine (CID 96733113) is (2R,4R)-2-methyl-4-propan-2-ylpiperidine.
What is the SMILES notation for (2R,4R)-2-methyl-4-propan-2-ylpiperidine?
The canonical SMILES for (2R,4R)-2-methyl-4-propan-2-ylpiperidine is CC(C)[C@@H]1CCN[C@H](C)C1.
What is the InChIKey of (2R,4R)-2-methyl-4-propan-2-ylpiperidine?
The InChIKey is FYMWCRNFTFSZBO-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H19N/c1-7(2)9-4-5-10-8(3)6-9/h7-10H,4-6H2,1-3H3/t8-,9-/m1/s1.
What are the key properties of (2R,4R)-2-methyl-4-propan-2-ylpiperidine?
(2R,4R)-2-methyl-4-propan-2-ylpiperidine has a molecular weight of 141.26 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4R)-2-methyl-4-propan-2-ylpiperidine is sourced from PubChem (CID 96733113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).