1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide

C14H20N2O3 — CID 9374659

IUPAC1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C14H20N2O3/c1-10(2)15-13(17)11-5-7-16(8-6-11)14(18)12-4-3-9-19-12/h3-4,9-11H,5-8H2,1-2H3,(H,15,17)
InChIKeyZATOLALCWMVYDQ-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.66
Rot. Bonds3

About 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide

1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide (PubChem CID 9374659) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
PubChem CID9374659
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide
SMILESCC(C)NC(=O)C1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C14H20N2O3/c1-10(2)15-13(17)11-5-7-16(8-6-11)14(18)12-4-3-9-19-12/h3-4,9-11H,5-8H2,1-2H3,(H,15,17)
InChIKeyZATOLALCWMVYDQ-UHFFFAOYSA-N
XLogP1.66
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide (CID 9374659) is 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide is CC(C)NC(=O)C1CCN(C(=O)c2ccco2)CC1.
What is the InChIKey of 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
The InChIKey is ZATOLALCWMVYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10(2)15-13(17)11-5-7-16(8-6-11)14(18)12-4-3-9-19-12/h3-4,9-11H,5-8H2,1-2H3,(H,15,17).
What are the key properties of 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide?
1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-carbonyl)-N-propan-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 9374659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).