2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide

C15H26N2O3 — CID 78964773

IUPAC2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCCN(CC(=O)N(C)Cc1ccc(C)o1)CC(C)(C)O
InChIInChI=1S/C15H26N2O3/c1-6-17(11-15(3,4)19)10-14(18)16(5)9-13-8-7-12(2)20-13/h7-8,19H,6,9-11H2,1-5H3
InChIKeySHOREKVGYRJOAT-UHFFFAOYSA-N
MW282.38 g/mol
LogP1.64
Rot. Bonds7

About 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide

2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide (PubChem CID 78964773) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
PubChem CID78964773
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
SMILESCCN(CC(=O)N(C)Cc1ccc(C)o1)CC(C)(C)O
InChIInChI=1S/C15H26N2O3/c1-6-17(11-15(3,4)19)10-14(18)16(5)9-13-8-7-12(2)20-13/h7-8,19H,6,9-11H2,1-5H3
InChIKeySHOREKVGYRJOAT-UHFFFAOYSA-N
XLogP1.64
TPSA56.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 78963094
2-[ethyl-[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]amino]-2-methylpropanoic acid
CID 62821164
2-methyl-1-[methyl-[(5-methylfuran-2-yl)methyl]amino]propan-2-ol
CID 60886966
methyl 2-[[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-propylamino]acetate
CID 62011760
tert-butyl 4-[methyl-[(5-methylfuran-2-yl)methyl]amino]-4-oxobutanoate
CID 106707019
2-methyl-2-[[2-[methyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]amino]propanoic acid
CID 65263837
methyl-[(5-methylfuran-2-yl)methyl]carbamothioic S-acid
CID 115170193
2-methyl-4-[methyl-[(5-methylfuran-2-yl)methyl]amino]-4-oxo-2-propan-2-ylbutanoic acid
CID 43526164
3-(4-ethylphenyl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 78794973
3-(3,5-ditert-butyl-4-hydroxyphenyl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 8852022
2-amino-N,3,3-trimethyl-N-[(5-methylfuran-2-yl)methyl]butanamide
CID 76893225
3-cyano-N-methyl-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 115173902

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
The IUPAC name of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide (CID 78964773) is 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide.
What is the SMILES notation for 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
The canonical SMILES for 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide is CCN(CC(=O)N(C)Cc1ccc(C)o1)CC(C)(C)O.
What is the InChIKey of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
The InChIKey is SHOREKVGYRJOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-6-17(11-15(3,4)19)10-14(18)16(5)9-13-8-7-12(2)20-13/h7-8,19H,6,9-11H2,1-5H3.
What are the key properties of 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide?
2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide has a molecular weight of 282.38 g/mol, XLogP of 1.64, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(2-hydroxy-2-methylpropyl)amino]-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide is sourced from PubChem (CID 78964773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).