(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

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Related Compounds

(2R,4R)-2-iodo-4-propan-2-ylpiperidine
CID 167503310
(2R,4R)-4-propan-2-ylpiperidin-2-ol
CID 125130328
(2S,6R)-2,6-dimethyl-4-propan-2-ylpiperidine
CID 158604768
6-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole
CID 83905624
(4R)-2,4-dimethylpiperidine
CID 144551274
N-methyl-2-(4-propan-2-ylpiperidin-2-yl)ethanamine
CID 170616684
(2S,4S)-2-methyl-N-propan-2-ylpiperidin-4-amine
CID 95913690
(2S,4S)-2-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide;hydrochloride
CID 120637437
(5S,7R)-5,7-dimethyl-1,4-diazepane
CID 55288229
methane;2-propan-2-ylazetidine;propan-2-ylcyclobutane
CID 159611359
(2R,4S)-2-methylpiperidine-4-thiol
CID 94843330
4-cyclopropyl-2-methylpiperidine
CID 82594092

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).