N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine

C15H20N2O2 — CID 26404342

IUPACN-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine
SMILESC=C(C)CN(CC)Cc1nc(-c2ccoc2)oc1C
InChIInChI=1S/C15H20N2O2/c1-5-17(8-11(2)3)9-14-12(4)19-15(16-14)13-6-7-18-10-13/h6-7,10H,2,5,8-9H2,1,3-4H3
InChIKeyCCASROSPKYZELP-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.64
Rot. Bonds6

About N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine

N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine (PubChem CID 26404342) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine.

Molecular Properties

Compound NameN-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine
PubChem CID26404342
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine
SMILESC=C(C)CN(CC)Cc1nc(-c2ccoc2)oc1C
InChIInChI=1S/C15H20N2O2/c1-5-17(8-11(2)3)9-14-12(4)19-15(16-14)13-6-7-18-10-13/h6-7,10H,2,5,8-9H2,1,3-4H3
InChIKeyCCASROSPKYZELP-UHFFFAOYSA-N
XLogP3.64
TPSA42.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine?
The IUPAC name of N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine (CID 26404342) is N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine.
What is the SMILES notation for N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine?
The canonical SMILES for N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine is C=C(C)CN(CC)Cc1nc(-c2ccoc2)oc1C.
What is the InChIKey of N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine?
The InChIKey is CCASROSPKYZELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-5-17(8-11(2)3)9-14-12(4)19-15(16-14)13-6-7-18-10-13/h6-7,10H,2,5,8-9H2,1,3-4H3.
What are the key properties of N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine?
N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine has a molecular weight of 260.34 g/mol, XLogP of 3.64, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[[2-(furan-3-yl)-5-methyl-1,3-oxazol-4-yl]methyl]-2-methylprop-2-en-1-amine is sourced from PubChem (CID 26404342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).