2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide

C11H18N2O2 — CID 86784230

IUPAC2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide
SMILESCCC(N)C(=O)N(CC)Cc1ccoc1
InChIInChI=1S/C11H18N2O2/c1-3-10(12)11(14)13(4-2)7-9-5-6-15-8-9/h5-6,8,10H,3-4,7,12H2,1-2H3
InChIKeyHYSGEWJVZJKXGY-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.37
Rot. Bonds5

About 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide

2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide (PubChem CID 86784230) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide.

Molecular Properties

Compound Name2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide
PubChem CID86784230
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide
SMILESCCC(N)C(=O)N(CC)Cc1ccoc1
InChIInChI=1S/C11H18N2O2/c1-3-10(12)11(14)13(4-2)7-9-5-6-15-8-9/h5-6,8,10H,3-4,7,12H2,1-2H3
InChIKeyHYSGEWJVZJKXGY-UHFFFAOYSA-N
XLogP1.37
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide?
The IUPAC name of 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide (CID 86784230) is 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide.
What is the SMILES notation for 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide?
The canonical SMILES for 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide is CCC(N)C(=O)N(CC)Cc1ccoc1.
What is the InChIKey of 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide?
The InChIKey is HYSGEWJVZJKXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-3-10(12)11(14)13(4-2)7-9-5-6-15-8-9/h5-6,8,10H,3-4,7,12H2,1-2H3.
What are the key properties of 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide?
2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide has a molecular weight of 210.28 g/mol, XLogP of 1.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-ethyl-N-(furan-3-ylmethyl)butanamide is sourced from PubChem (CID 86784230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).