3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol

C16H33NO — CID 23328920

IUPAC3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol
SMILESCCCC(CCC)CC1CCN(CCCO)CC1
InChIInChI=1S/C16H33NO/c1-3-6-15(7-4-2)14-16-8-11-17(12-9-16)10-5-13-18/h15-16,18H,3-14H2,1-2H3
InChIKeyGULGFADNCOZHJV-UHFFFAOYSA-N
MW255.45 g/mol
LogP3.69
Rot. Bonds9

About 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol

3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol (PubChem CID 23328920) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol.

Molecular Properties

Compound Name3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol
PubChem CID23328920
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol
SMILESCCCC(CCC)CC1CCN(CCCO)CC1
InChIInChI=1S/C16H33NO/c1-3-6-15(7-4-2)14-16-8-11-17(12-9-16)10-5-13-18/h15-16,18H,3-14H2,1-2H3
InChIKeyGULGFADNCOZHJV-UHFFFAOYSA-N
XLogP3.69
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol?
The IUPAC name of 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol (CID 23328920) is 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol.
What is the SMILES notation for 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol?
The canonical SMILES for 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol is CCCC(CCC)CC1CCN(CCCO)CC1.
What is the InChIKey of 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol?
The InChIKey is GULGFADNCOZHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-3-6-15(7-4-2)14-16-8-11-17(12-9-16)10-5-13-18/h15-16,18H,3-14H2,1-2H3.
What are the key properties of 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol?
3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol has a molecular weight of 255.45 g/mol, XLogP of 3.69, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-propylpentyl)piperidin-1-yl]propan-1-ol is sourced from PubChem (CID 23328920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).