(3S)-3-methyl-3-propan-2-ylpiperidin-2-ol

C9H19NO — CID 166749503

IUPAC(3S)-3-methyl-3-propan-2-ylpiperidin-2-ol
SMILESCC(C)[C@]1(C)CCCNC1O
InChIInChI=1S/C9H19NO/c1-7(2)9(3)5-4-6-10-8(9)11/h7-8,10-11H,4-6H2,1-3H3/t8?,9-/m0/s1
InChIKeyLDFBNPTYCJRWJD-GKAPJAKFSA-N
MW157.26 g/mol
LogP1.35
Rot. Bonds1

About (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol

(3S)-3-methyl-3-propan-2-ylpiperidin-2-ol (PubChem CID 166749503) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol.

Molecular Properties

Compound Name(3S)-3-methyl-3-propan-2-ylpiperidin-2-ol
PubChem CID166749503
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name(3S)-3-methyl-3-propan-2-ylpiperidin-2-ol
SMILESCC(C)[C@]1(C)CCCNC1O
InChIInChI=1S/C9H19NO/c1-7(2)9(3)5-4-6-10-8(9)11/h7-8,10-11H,4-6H2,1-3H3/t8?,9-/m0/s1
InChIKeyLDFBNPTYCJRWJD-GKAPJAKFSA-N
XLogP1.35
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1,1,3-trimethyl-3-propan-2-ylcyclohexane
CID 144667532
(4S)-4-methyl-4-propan-2-ylpiperidine-3-thiol
CID 134386945
(2-propan-2-ylpyrrolidin-2-yl)methanol
CID 84648893
4-methyl-3,4-di(propan-2-yl)piperidine
CID 79320143
1-(piperidin-2-yloxyamino)ethanol
CID 57158049
tert-butyl 3-hydroxy-3-methylpiperidine-2-carboxylate
CID 86601016
(2R)-2-methylpyrrolidin-2-ol
CID 146841570
(2S)-3,3-dimethylpiperidine-2-carboxylic acid
CID 93492996
(2R)-3-methyl-2-[(2S)-pyrrolidin-2-yl]butan-2-ol
CID 138485633
3-cyclopentyl-4-methyl-4-propan-2-ylpiperidine
CID 112570765
(4aS)-4a-methyl-1,2,3,4,5,6,7,7a-octahydrocyclopenta[b]pyridine
CID 176835290
2-methyl-2-propan-2-ylpiperidin-4-ol;hydrochloride
CID 115019690

Frequently Asked Questions

What is the IUPAC name of (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol?
The IUPAC name of (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol (CID 166749503) is (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol.
What is the SMILES notation for (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol?
The canonical SMILES for (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol is CC(C)[C@]1(C)CCCNC1O.
What is the InChIKey of (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol?
The InChIKey is LDFBNPTYCJRWJD-GKAPJAKFSA-N. The full InChI is InChI=1S/C9H19NO/c1-7(2)9(3)5-4-6-10-8(9)11/h7-8,10-11H,4-6H2,1-3H3/t8?,9-/m0/s1.
What are the key properties of (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol?
(3S)-3-methyl-3-propan-2-ylpiperidin-2-ol has a molecular weight of 157.26 g/mol, XLogP of 1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-3-propan-2-ylpiperidin-2-ol is sourced from PubChem (CID 166749503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).