(3-ethylpiperidin-3-yl)methanol

C8H17NO — CID 44827704

IUPAC(3-ethylpiperidin-3-yl)methanol
SMILESCCC1(CO)CCCNC1
InChIInChI=1S/C8H17NO/c1-2-8(7-10)4-3-5-9-6-8/h9-10H,2-7H2,1H3
InChIKeyXLRLUGYPWYNJGD-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.76
Rot. Bonds2

About (3-ethylpiperidin-3-yl)methanol

(3-ethylpiperidin-3-yl)methanol (PubChem CID 44827704) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (3-ethylpiperidin-3-yl)methanol.

Molecular Properties

Compound Name(3-ethylpiperidin-3-yl)methanol
PubChem CID44827704
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(3-ethylpiperidin-3-yl)methanol
SMILESCCC1(CO)CCCNC1
InChIInChI=1S/C8H17NO/c1-2-8(7-10)4-3-5-9-6-8/h9-10H,2-7H2,1H3
InChIKeyXLRLUGYPWYNJGD-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.76
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?
The IUPAC name of (3-ethylpiperidin-3-yl)methanol (CID 44827704) is (3-ethylpiperidin-3-yl)methanol.
What is the SMILES notation for (3-ethylpiperidin-3-yl)methanol?
The canonical SMILES for (3-ethylpiperidin-3-yl)methanol is CCC1(CO)CCCNC1.
What is the InChIKey of (3-ethylpiperidin-3-yl)methanol?
The InChIKey is XLRLUGYPWYNJGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-8(7-10)4-3-5-9-6-8/h9-10H,2-7H2,1H3.
What are the key properties of (3-ethylpiperidin-3-yl)methanol?
(3-ethylpiperidin-3-yl)methanol has a molecular weight of 143.23 g/mol, XLogP of 0.76, 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 is sourced from PubChem (CID 44827704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).