[2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone

C18H26N2O3 — CID 56820962

IUPAC[2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone
SMILESCC1CN(C2CCN(C(=O)C3CC3c3ccco3)CC2)CCO1
InChIInChI=1S/C18H26N2O3/c1-13-12-20(8-10-22-13)14-4-6-19(7-5-14)18(21)16-11-15(16)17-3-2-9-23-17/h2-3,9,13-16H,4-8,10-12H2,1H3
InChIKeyZQBIQNAILHIKFR-UHFFFAOYSA-N
MW318.42 g/mol
LogP2.09
Rot. Bonds3

About [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone

[2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone (PubChem CID 56820962) has the molecular formula C18H26N2O3 and a molecular weight of 318.42 g/mol. Its IUPAC name is [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name[2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone
PubChem CID56820962
Molecular FormulaC18H26N2O3
Molecular Weight318.42 g/mol
Exact Mass318.19
IUPAC Name[2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone
SMILESCC1CN(C2CCN(C(=O)C3CC3c3ccco3)CC2)CCO1
InChIInChI=1S/C18H26N2O3/c1-13-12-20(8-10-22-13)14-4-6-19(7-5-14)18(21)16-11-15(16)17-3-2-9-23-17/h2-3,9,13-16H,4-8,10-12H2,1H3
InChIKeyZQBIQNAILHIKFR-UHFFFAOYSA-N
XLogP2.09
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone?
The IUPAC name of [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone (CID 56820962) is [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone.
What is the SMILES notation for [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone?
The canonical SMILES for [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone is CC1CN(C2CCN(C(=O)C3CC3c3ccco3)CC2)CCO1.
What is the InChIKey of [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone?
The InChIKey is ZQBIQNAILHIKFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3/c1-13-12-20(8-10-22-13)14-4-6-19(7-5-14)18(21)16-11-15(16)17-3-2-9-23-17/h2-3,9,13-16H,4-8,10-12H2,1H3.
What are the key properties of [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone?
[2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone has a molecular weight of 318.42 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-yl)cyclopropyl]-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 56820962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).