2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide

C12H18N2O2 — CID 1246144

IUPAC2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide
SMILESCc1occc1C(=O)NC1CCN(C)CC1
InChIInChI=1S/C12H18N2O2/c1-9-11(5-8-16-9)12(15)13-10-3-6-14(2)7-4-10/h5,8,10H,3-4,6-7H2,1-2H3,(H,13,15)
InChIKeyUILUKJODZRPRIF-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.41
Rot. Bonds2

About 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide

2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide (PubChem CID 1246144) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide
PubChem CID1246144
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide
SMILESCc1occc1C(=O)NC1CCN(C)CC1
InChIInChI=1S/C12H18N2O2/c1-9-11(5-8-16-9)12(15)13-10-3-6-14(2)7-4-10/h5,8,10H,3-4,6-7H2,1-2H3,(H,13,15)
InChIKeyUILUKJODZRPRIF-UHFFFAOYSA-N
XLogP1.41
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide?
The IUPAC name of 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide (CID 1246144) is 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide?
The canonical SMILES for 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide is Cc1occc1C(=O)NC1CCN(C)CC1.
What is the InChIKey of 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide?
The InChIKey is UILUKJODZRPRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-11(5-8-16-9)12(15)13-10-3-6-14(2)7-4-10/h5,8,10H,3-4,6-7H2,1-2H3,(H,13,15).
What are the key properties of 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide?
2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-methylpiperidin-4-yl)furan-3-carboxamide is sourced from PubChem (CID 1246144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).