4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide

C19H26N2O3S — CID 51283119

IUPAC4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide
SMILESCCc1cc(C(=O)NCC(c2ccc(C)o2)N2CCOCC2)sc1C
InChIInChI=1S/C19H26N2O3S/c1-4-15-11-18(25-14(15)3)19(22)20-12-16(17-6-5-13(2)24-17)21-7-9-23-10-8-21/h5-6,11,16H,4,7-10,12H2,1-3H3,(H,20,22)
InChIKeyGZJTWSMYOBCMMU-UHFFFAOYSA-N
MW362.50 g/mol
LogP3.32
Rot. Bonds6

About 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide

4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide (PubChem CID 51283119) has the molecular formula C19H26N2O3S and a molecular weight of 362.50 g/mol. Its IUPAC name is 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide
PubChem CID51283119
Molecular FormulaC19H26N2O3S
Molecular Weight362.50 g/mol
Exact Mass362.17
IUPAC Name4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide
SMILESCCc1cc(C(=O)NCC(c2ccc(C)o2)N2CCOCC2)sc1C
InChIInChI=1S/C19H26N2O3S/c1-4-15-11-18(25-14(15)3)19(22)20-12-16(17-6-5-13(2)24-17)21-7-9-23-10-8-21/h5-6,11,16H,4,7-10,12H2,1-3H3,(H,20,22)
InChIKeyGZJTWSMYOBCMMU-UHFFFAOYSA-N
XLogP3.32
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.50
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide?
The IUPAC name of 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide (CID 51283119) is 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide?
The canonical SMILES for 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide is CCc1cc(C(=O)NCC(c2ccc(C)o2)N2CCOCC2)sc1C.
What is the InChIKey of 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide?
The InChIKey is GZJTWSMYOBCMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3S/c1-4-15-11-18(25-14(15)3)19(22)20-12-16(17-6-5-13(2)24-17)21-7-9-23-10-8-21/h5-6,11,16H,4,7-10,12H2,1-3H3,(H,20,22).
What are the key properties of 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide?
4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide has a molecular weight of 362.50 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]thiophene-2-carboxamide is sourced from PubChem (CID 51283119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).