(2S)-2-propan-2-ylpiperidine

C8H17N — CID 7022854

IUPAC(2S)-2-propan-2-ylpiperidine
SMILESCC(C)[C@@H]1CCCCN1
InChIInChI=1S/C8H17N/c1-7(2)8-5-3-4-6-9-8/h7-9H,3-6H2,1-2H3/t8-/m0/s1
InChIKeyUGZMDPJPZIDCOA-QMMMGPOBSA-N
MW127.23 g/mol
LogP1.78
Rot. Bonds1

About (2S)-2-propan-2-ylpiperidine

(2S)-2-propan-2-ylpiperidine (PubChem CID 7022854) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is (2S)-2-propan-2-ylpiperidine.

Molecular Properties

Compound Name(2S)-2-propan-2-ylpiperidine
PubChem CID7022854
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name(2S)-2-propan-2-ylpiperidine
SMILESCC(C)[C@@H]1CCCCN1
InChIInChI=1S/C8H17N/c1-7(2)8-5-3-4-6-9-8/h7-9H,3-6H2,1-2H3/t8-/m0/s1
InChIKeyUGZMDPJPZIDCOA-QMMMGPOBSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-propan-2-ylazepane
CID 7048221
ethane;2-propan-2-ylpiperidine
CID 154671868
2-(1-piperidin-2-ylethyl)piperidine
CID 19900914
(2R)-2-butan-2-ylpiperidine
CID 145087457
(2S)-2-[(2R,3S)-3-[(2S)-pyrrolidin-2-yl]butan-2-yl]pyrrolidine
CID 129418670
methane;2-propan-2-ylazetidine;propan-2-ylcyclobutane
CID 159611359
2-(1-fluoro-2-methylpropyl)azepane
CID 105435678
(2S)-2-pentan-3-ylpiperidine
CID 7048107
2-pentan-3-ylpiperidine
CID 4527381
ethane;tetrakis(propan-2-ylcyclohexane);1-propan-2-ylpiperidine;2-propan-2-ylpiperidine;4-propan-2-ylpiperidine
CID 158490394
(2S,6S)-2,6-di(propan-2-yl)piperidine;methane
CID 157197776
2-(1-fluoro-3-methylbutyl)piperidine
CID 105435680

Frequently Asked Questions

What is the IUPAC name of (2S)-2-propan-2-ylpiperidine?
The IUPAC name of (2S)-2-propan-2-ylpiperidine (CID 7022854) is (2S)-2-propan-2-ylpiperidine.
What is the SMILES notation for (2S)-2-propan-2-ylpiperidine?
The canonical SMILES for (2S)-2-propan-2-ylpiperidine is CC(C)[C@@H]1CCCCN1.
What is the InChIKey of (2S)-2-propan-2-ylpiperidine?
The InChIKey is UGZMDPJPZIDCOA-QMMMGPOBSA-N. The full InChI is InChI=1S/C8H17N/c1-7(2)8-5-3-4-6-9-8/h7-9H,3-6H2,1-2H3/t8-/m0/s1.
What are the key properties of (2S)-2-propan-2-ylpiperidine?
(2S)-2-propan-2-ylpiperidine has a molecular weight of 127.23 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-propan-2-ylpiperidine is sourced from PubChem (CID 7022854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).