(3-ethylpiperidin-3-yl)methanol;hydrochloride

C8H18ClNO — CID 75467424

IUPAC(3-ethylpiperidin-3-yl)methanol;hydrochloride
SMILESCCC1(CO)CCCNC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-2-8(7-10)4-3-5-9-6-8;/h9-10H,2-7H2,1H3;1H
InChIKeyGUUQFBOCLPXRIC-UHFFFAOYSA-N
MW179.69 g/mol
LogP1.18
Rot. Bonds2

About (3-ethylpiperidin-3-yl)methanol;hydrochloride

(3-ethylpiperidin-3-yl)methanol;hydrochloride (PubChem CID 75467424) has the molecular formula C8H18ClNO and a molecular weight of 179.69 g/mol. Its IUPAC name is (3-ethylpiperidin-3-yl)methanol;hydrochloride.

Molecular Properties

Compound Name(3-ethylpiperidin-3-yl)methanol;hydrochloride
PubChem CID75467424
Molecular FormulaC8H18ClNO
Molecular Weight179.69 g/mol
Exact Mass179.11
IUPAC Name(3-ethylpiperidin-3-yl)methanol;hydrochloride
SMILESCCC1(CO)CCCNC1.Cl
InChIInChI=1S/C8H17NO.ClH/c1-2-8(7-10)4-3-5-9-6-8;/h9-10H,2-7H2,1H3;1H
InChIKeyGUUQFBOCLPXRIC-UHFFFAOYSA-N
XLogP1.18
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.69
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3-ethylpiperidin-3-yl)methanol;hydrochloride?
The IUPAC name of (3-ethylpiperidin-3-yl)methanol;hydrochloride (CID 75467424) is (3-ethylpiperidin-3-yl)methanol;hydrochloride.
What is the SMILES notation for (3-ethylpiperidin-3-yl)methanol;hydrochloride?
The canonical SMILES for (3-ethylpiperidin-3-yl)methanol;hydrochloride is CCC1(CO)CCCNC1.Cl.
What is the InChIKey of (3-ethylpiperidin-3-yl)methanol;hydrochloride?
The InChIKey is GUUQFBOCLPXRIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO.ClH/c1-2-8(7-10)4-3-5-9-6-8;/h9-10H,2-7H2,1H3;1H.
What are the key properties of (3-ethylpiperidin-3-yl)methanol;hydrochloride?
(3-ethylpiperidin-3-yl)methanol;hydrochloride has a molecular weight of 179.69 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylpiperidin-3-yl)methanol;hydrochloride is sourced from PubChem (CID 75467424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).