ethane;3-(2-methylpropyl)piperidin-4-ol

C11H25NO — CID 143575873

IUPACethane;3-(2-methylpropyl)piperidin-4-ol
SMILESCC.CC(C)CC1CNCCC1O
InChIInChI=1S/C9H19NO.C2H6/c1-7(2)5-8-6-10-4-3-9(8)11;1-2/h7-11H,3-6H2,1-2H3;1-2H3
InChIKeyOAFSVRJHHPYUIA-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.03
Rot. Bonds2

About ethane;3-(2-methylpropyl)piperidin-4-ol

ethane;3-(2-methylpropyl)piperidin-4-ol (PubChem CID 143575873) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is ethane;3-(2-methylpropyl)piperidin-4-ol.

Molecular Properties

Compound Nameethane;3-(2-methylpropyl)piperidin-4-ol
PubChem CID143575873
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Nameethane;3-(2-methylpropyl)piperidin-4-ol
SMILESCC.CC(C)CC1CNCCC1O
InChIInChI=1S/C9H19NO.C2H6/c1-7(2)5-8-6-10-4-3-9(8)11;1-2/h7-11H,3-6H2,1-2H3;1-2H3
InChIKeyOAFSVRJHHPYUIA-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4S)-3-(2-methylpropyl)piperidin-4-ol
CID 93495959
(3R,4R)-3-(2-methylpropyl)piperidin-4-ol
CID 93495960
3-(3-hydroxy-2-methylpropyl)piperidin-4-ol
CID 114451948
3-(2-methoxypropyl)piperidin-4-ol
CID 114451812
3-(2-hydroxy-3-methoxypropyl)piperidin-4-ol
CID 114451767
[3-(2-methylpropyl)piperidin-4-yl]methanamine
CID 84765835
(3S,4S)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129393768
4-(3-cyclopropylphenyl)-3-(2-methylpropyl)piperidine
CID 79978067
4-(2-fluoro-5-methylphenyl)-3-(2-methylpropyl)piperidine
CID 114055081
4-(3-methylphenyl)-3-(2-methylpropyl)piperidine
CID 79320999
4-(3-fluorophenyl)-3-(2-methylpropyl)piperidine
CID 79321584
3-[(1-butan-2-ylpyrazol-3-yl)methyl]piperidin-4-ol
CID 114451905

Frequently Asked Questions

What is the IUPAC name of ethane;3-(2-methylpropyl)piperidin-4-ol?
The IUPAC name of ethane;3-(2-methylpropyl)piperidin-4-ol (CID 143575873) is ethane;3-(2-methylpropyl)piperidin-4-ol.
What is the SMILES notation for ethane;3-(2-methylpropyl)piperidin-4-ol?
The canonical SMILES for ethane;3-(2-methylpropyl)piperidin-4-ol is CC.CC(C)CC1CNCCC1O.
What is the InChIKey of ethane;3-(2-methylpropyl)piperidin-4-ol?
The InChIKey is OAFSVRJHHPYUIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO.C2H6/c1-7(2)5-8-6-10-4-3-9(8)11;1-2/h7-11H,3-6H2,1-2H3;1-2H3.
What are the key properties of ethane;3-(2-methylpropyl)piperidin-4-ol?
ethane;3-(2-methylpropyl)piperidin-4-ol has a molecular weight of 187.33 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(2-methylpropyl)piperidin-4-ol is sourced from PubChem (CID 143575873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).