N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide

C15H24N2O3 — CID 16809722

IUPACN-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide
SMILESCC(C)CC(=O)NCC(c1ccco1)N1CCOCC1
InChIInChI=1S/C15H24N2O3/c1-12(2)10-15(18)16-11-13(14-4-3-7-20-14)17-5-8-19-9-6-17/h3-4,7,12-13H,5-6,8-11H2,1-2H3,(H,16,18)
InChIKeyMTKGCZXUNAHXMK-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.82
Rot. Bonds6

About N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide

N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide (PubChem CID 16809722) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide
PubChem CID16809722
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide
SMILESCC(C)CC(=O)NCC(c1ccco1)N1CCOCC1
InChIInChI=1S/C15H24N2O3/c1-12(2)10-15(18)16-11-13(14-4-3-7-20-14)17-5-8-19-9-6-17/h3-4,7,12-13H,5-6,8-11H2,1-2H3,(H,16,18)
InChIKeyMTKGCZXUNAHXMK-UHFFFAOYSA-N
XLogP1.82
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide?
The IUPAC name of N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide (CID 16809722) is N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide is CC(C)CC(=O)NCC(c1ccco1)N1CCOCC1.
What is the InChIKey of N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide?
The InChIKey is MTKGCZXUNAHXMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-12(2)10-15(18)16-11-13(14-4-3-7-20-14)17-5-8-19-9-6-17/h3-4,7,12-13H,5-6,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide?
N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide has a molecular weight of 280.37 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-morpholin-4-ylethyl]-3-methylbutanamide is sourced from PubChem (CID 16809722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).