N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide

C19H30N2O5 — CID 55713256

IUPACN-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide
SMILESCc1ccc(C(CNC(=O)CCOCC2CCCO2)N2CCOCC2)o1
InChIInChI=1S/C19H30N2O5/c1-15-4-5-18(26-15)17(21-7-11-23-12-8-21)13-20-19(22)6-10-24-14-16-3-2-9-25-16/h4-5,16-17H,2-3,6-14H2,1H3,(H,20,22)
InChIKeyMUOAQHWJUFGNJJ-UHFFFAOYSA-N
MW366.46 g/mol
LogP1.66
Rot. Bonds9

About N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide

N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide (PubChem CID 55713256) has the molecular formula C19H30N2O5 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide.

Molecular Properties

Compound NameN-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide
PubChem CID55713256
Molecular FormulaC19H30N2O5
Molecular Weight366.46 g/mol
Exact Mass366.22
IUPAC NameN-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide
SMILESCc1ccc(C(CNC(=O)CCOCC2CCCO2)N2CCOCC2)o1
InChIInChI=1S/C19H30N2O5/c1-15-4-5-18(26-15)17(21-7-11-23-12-8-21)13-20-19(22)6-10-24-14-16-3-2-9-25-16/h4-5,16-17H,2-3,6-14H2,1H3,(H,20,22)
InChIKeyMUOAQHWJUFGNJJ-UHFFFAOYSA-N
XLogP1.66
TPSA73.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide?
The IUPAC name of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide (CID 55713256) is N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide.
What is the SMILES notation for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide?
The canonical SMILES for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide is Cc1ccc(C(CNC(=O)CCOCC2CCCO2)N2CCOCC2)o1.
What is the InChIKey of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide?
The InChIKey is MUOAQHWJUFGNJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O5/c1-15-4-5-18(26-15)17(21-7-11-23-12-8-21)13-20-19(22)6-10-24-14-16-3-2-9-25-16/h4-5,16-17H,2-3,6-14H2,1H3,(H,20,22).
What are the key properties of N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide?
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide has a molecular weight of 366.46 g/mol, XLogP of 1.66, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide is sourced from PubChem (CID 55713256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).