1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine

C14H18N2O — CID 83182583

IUPAC1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine
SMILESCCc1cccnc1C(Cc1ccco1)NC
InChIInChI=1S/C14H18N2O/c1-3-11-6-4-8-16-14(11)13(15-2)10-12-7-5-9-17-12/h4-9,13,15H,3,10H2,1-2H3
InChIKeySQFYBVGFFBJENY-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.74
Rot. Bonds5

About 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine

1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine (PubChem CID 83182583) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine
PubChem CID83182583
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine
SMILESCCc1cccnc1C(Cc1ccco1)NC
InChIInChI=1S/C14H18N2O/c1-3-11-6-4-8-16-14(11)13(15-2)10-12-7-5-9-17-12/h4-9,13,15H,3,10H2,1-2H3
InChIKeySQFYBVGFFBJENY-UHFFFAOYSA-N
XLogP2.74
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine?
The IUPAC name of 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine (CID 83182583) is 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine.
What is the SMILES notation for 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine?
The canonical SMILES for 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine is CCc1cccnc1C(Cc1ccco1)NC.
What is the InChIKey of 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine?
The InChIKey is SQFYBVGFFBJENY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-3-11-6-4-8-16-14(11)13(15-2)10-12-7-5-9-17-12/h4-9,13,15H,3,10H2,1-2H3.
What are the key properties of 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine?
1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine has a molecular weight of 230.31 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-2-pyridinyl)-2-(furan-2-yl)-N-methylethanamine is sourced from PubChem (CID 83182583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).