1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide

C15H20N2O3 — CID 47451854

IUPAC1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)C1CC1c1ccco1
InChIInChI=1S/C15H20N2O3/c1-9-4-5-10(14(16)18)8-17(9)15(19)12-7-11(12)13-3-2-6-20-13/h2-3,6,9-12H,4-5,7-8H2,1H3,(H2,16,18)
InChIKeyISHYXLRWOVFKRZ-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.50
Rot. Bonds3

About 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide

1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide (PubChem CID 47451854) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide
PubChem CID47451854
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1C(=O)C1CC1c1ccco1
InChIInChI=1S/C15H20N2O3/c1-9-4-5-10(14(16)18)8-17(9)15(19)12-7-11(12)13-3-2-6-20-13/h2-3,6,9-12H,4-5,7-8H2,1H3,(H2,16,18)
InChIKeyISHYXLRWOVFKRZ-UHFFFAOYSA-N
XLogP1.50
TPSA76.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide (CID 47451854) is 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1C(=O)C1CC1c1ccco1.
What is the InChIKey of 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide?
The InChIKey is ISHYXLRWOVFKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-9-4-5-10(14(16)18)8-17(9)15(19)12-7-11(12)13-3-2-6-20-13/h2-3,6,9-12H,4-5,7-8H2,1H3,(H2,16,18).
What are the key properties of 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide?
1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(furan-2-yl)cyclopropanecarbonyl]-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 47451854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).