(1-butylpiperidin-4-yl)methanol

C10H21NO — CID 10241250

IUPAC(1-butylpiperidin-4-yl)methanol
SMILESCCCCN1CCC(CO)CC1
InChIInChI=1S/C10H21NO/c1-2-3-6-11-7-4-10(9-12)5-8-11/h10,12H,2-9H2,1H3
InChIKeyWBJOIIUQZHTVOG-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds4

About (1-butylpiperidin-4-yl)methanol

(1-butylpiperidin-4-yl)methanol (PubChem CID 10241250) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (1-butylpiperidin-4-yl)methanol.

Molecular Properties

Compound Name(1-butylpiperidin-4-yl)methanol
PubChem CID10241250
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(1-butylpiperidin-4-yl)methanol
SMILESCCCCN1CCC(CO)CC1
InChIInChI=1S/C10H21NO/c1-2-3-6-11-7-4-10(9-12)5-8-11/h10,12H,2-9H2,1H3
InChIKeyWBJOIIUQZHTVOG-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-butylpiperidin-4-yl)methanol?
The IUPAC name of (1-butylpiperidin-4-yl)methanol (CID 10241250) is (1-butylpiperidin-4-yl)methanol.
What is the SMILES notation for (1-butylpiperidin-4-yl)methanol?
The canonical SMILES for (1-butylpiperidin-4-yl)methanol is CCCCN1CCC(CO)CC1.
What is the InChIKey of (1-butylpiperidin-4-yl)methanol?
The InChIKey is WBJOIIUQZHTVOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-2-3-6-11-7-4-10(9-12)5-8-11/h10,12H,2-9H2,1H3.
What are the key properties of (1-butylpiperidin-4-yl)methanol?
(1-butylpiperidin-4-yl)methanol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-butylpiperidin-4-yl)methanol is sourced from PubChem (CID 10241250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).