N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide

C16H31N3O — CID 83022184

IUPACN-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NN2C(C)CCCC2C)CCNCC1
InChIInChI=1S/C16H31N3O/c1-4-8-16(9-11-17-12-10-16)15(20)18-19-13(2)6-5-7-14(19)3/h13-14,17H,4-12H2,1-3H3,(H,18,20)
InChIKeyZPZZJTAQHQNKOX-UHFFFAOYSA-N
MW281.44 g/mol
LogP2.45
Rot. Bonds4

About N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide

N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide (PubChem CID 83022184) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide
PubChem CID83022184
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide
SMILESCCCC1(C(=O)NN2C(C)CCCC2C)CCNCC1
InChIInChI=1S/C16H31N3O/c1-4-8-16(9-11-17-12-10-16)15(20)18-19-13(2)6-5-7-14(19)3/h13-14,17H,4-12H2,1-3H3,(H,18,20)
InChIKeyZPZZJTAQHQNKOX-UHFFFAOYSA-N
XLogP2.45
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide?
The IUPAC name of N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide (CID 83022184) is N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide?
The canonical SMILES for N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide is CCCC1(C(=O)NN2C(C)CCCC2C)CCNCC1.
What is the InChIKey of N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide?
The InChIKey is ZPZZJTAQHQNKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-4-8-16(9-11-17-12-10-16)15(20)18-19-13(2)6-5-7-14(19)3/h13-14,17H,4-12H2,1-3H3,(H,18,20).
What are the key properties of N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide?
N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide has a molecular weight of 281.44 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylpiperidin-1-yl)-4-propylpiperidine-4-carboxamide is sourced from PubChem (CID 83022184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).