2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide

C15H24N2O3 — CID 62473759

IUPAC2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide
SMILESCOCCC(N)C(=O)N(C)Cc1ccc(C2CC2C)o1
InChIInChI=1S/C15H24N2O3/c1-10-8-12(10)14-5-4-11(20-14)9-17(2)15(18)13(16)6-7-19-3/h4-5,10,12-13H,6-9,16H2,1-3H3
InChIKeyIYTVSGDXOXCRRY-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.73
Rot. Bonds7

About 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide

2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide (PubChem CID 62473759) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide.

Molecular Properties

Compound Name2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide
PubChem CID62473759
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide
SMILESCOCCC(N)C(=O)N(C)Cc1ccc(C2CC2C)o1
InChIInChI=1S/C15H24N2O3/c1-10-8-12(10)14-5-4-11(20-14)9-17(2)15(18)13(16)6-7-19-3/h4-5,10,12-13H,6-9,16H2,1-3H3
InChIKeyIYTVSGDXOXCRRY-UHFFFAOYSA-N
XLogP1.73
TPSA68.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide?
The IUPAC name of 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide (CID 62473759) is 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide.
What is the SMILES notation for 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide?
The canonical SMILES for 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide is COCCC(N)C(=O)N(C)Cc1ccc(C2CC2C)o1.
What is the InChIKey of 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide?
The InChIKey is IYTVSGDXOXCRRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-10-8-12(10)14-5-4-11(20-14)9-17(2)15(18)13(16)6-7-19-3/h4-5,10,12-13H,6-9,16H2,1-3H3.
What are the key properties of 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide?
2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide has a molecular weight of 280.37 g/mol, XLogP of 1.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methoxy-N-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]butanamide is sourced from PubChem (CID 62473759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).