3-(1-propylpiperidin-3-yl)benzamide;hydrochloride

C15H23ClN2O — CID 45259865

IUPAC3-(1-propylpiperidin-3-yl)benzamide;hydrochloride
SMILESCCCN1CCCC(c2cccc(C(N)=O)c2)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-2-8-17-9-4-7-14(11-17)12-5-3-6-13(10-12)15(16)18;/h3,5-6,10,14H,2,4,7-9,11H2,1H3,(H2,16,18);1H
InChIKeyUISMROKTERECLL-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.80
Rot. Bonds4

About 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride

3-(1-propylpiperidin-3-yl)benzamide;hydrochloride (PubChem CID 45259865) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride.

Molecular Properties

Compound Name3-(1-propylpiperidin-3-yl)benzamide;hydrochloride
PubChem CID45259865
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name3-(1-propylpiperidin-3-yl)benzamide;hydrochloride
SMILESCCCN1CCCC(c2cccc(C(N)=O)c2)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-2-8-17-9-4-7-14(11-17)12-5-3-6-13(10-12)15(16)18;/h3,5-6,10,14H,2,4,7-9,11H2,1H3,(H2,16,18);1H
InChIKeyUISMROKTERECLL-UHFFFAOYSA-N
XLogP2.80
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride?
The IUPAC name of 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride (CID 45259865) is 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride.
What is the SMILES notation for 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride?
The canonical SMILES for 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride is CCCN1CCCC(c2cccc(C(N)=O)c2)C1.Cl.
What is the InChIKey of 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride?
The InChIKey is UISMROKTERECLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-2-8-17-9-4-7-14(11-17)12-5-3-6-13(10-12)15(16)18;/h3,5-6,10,14H,2,4,7-9,11H2,1H3,(H2,16,18);1H.
What are the key properties of 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride?
3-(1-propylpiperidin-3-yl)benzamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-propylpiperidin-3-yl)benzamide;hydrochloride is sourced from PubChem (CID 45259865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).