1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine

C15H20N2O2 — CID 103175544

IUPAC1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine
SMILESCCc1nc(C)ccc1OCc1ccc(CNC)o1
InChIInChI=1S/C15H20N2O2/c1-4-14-15(8-5-11(2)17-14)18-10-13-7-6-12(19-13)9-16-3/h5-8,16H,4,9-10H2,1-3H3
InChIKeyPYGVUQKFKRFNCS-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.84
Rot. Bonds6

About 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine

1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine (PubChem CID 103175544) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine
PubChem CID103175544
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine
SMILESCCc1nc(C)ccc1OCc1ccc(CNC)o1
InChIInChI=1S/C15H20N2O2/c1-4-14-15(8-5-11(2)17-14)18-10-13-7-6-12(19-13)9-16-3/h5-8,16H,4,9-10H2,1-3H3
InChIKeyPYGVUQKFKRFNCS-UHFFFAOYSA-N
XLogP2.84
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine (CID 103175544) is 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine is CCc1nc(C)ccc1OCc1ccc(CNC)o1.
What is the InChIKey of 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine?
The InChIKey is PYGVUQKFKRFNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-14-15(8-5-11(2)17-14)18-10-13-7-6-12(19-13)9-16-3/h5-8,16H,4,9-10H2,1-3H3.
What are the key properties of 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine?
1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine has a molecular weight of 260.34 g/mol, XLogP of 2.84, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(2-ethyl-6-methyl-3-pyridinyl)oxymethyl]furan-2-yl]-N-methylmethanamine is sourced from PubChem (CID 103175544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).