1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine

C14H18N2O — CID 105034717

IUPAC1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine
SMILESCCc1ccc(C(Cc2cccnc2)NC)o1
InChIInChI=1S/C14H18N2O/c1-3-12-6-7-14(17-12)13(15-2)9-11-5-4-8-16-10-11/h4-8,10,13,15H,3,9H2,1-2H3
InChIKeyLDVHQKIWIPTVBS-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.74
Rot. Bonds5

About 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine

1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine (PubChem CID 105034717) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine.

Molecular Properties

Compound Name1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine
PubChem CID105034717
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine
SMILESCCc1ccc(C(Cc2cccnc2)NC)o1
InChIInChI=1S/C14H18N2O/c1-3-12-6-7-14(17-12)13(15-2)9-11-5-4-8-16-10-11/h4-8,10,13,15H,3,9H2,1-2H3
InChIKeyLDVHQKIWIPTVBS-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-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine?
The IUPAC name of 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine (CID 105034717) is 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine.
What is the SMILES notation for 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine?
The canonical SMILES for 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine is CCc1ccc(C(Cc2cccnc2)NC)o1.
What is the InChIKey of 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine?
The InChIKey is LDVHQKIWIPTVBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-3-12-6-7-14(17-12)13(15-2)9-11-5-4-8-16-10-11/h4-8,10,13,15H,3,9H2,1-2H3.
What are the key properties of 1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine?
1-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine 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-(5-ethylfuran-2-yl)-N-methyl-2-pyridin-3-ylethanamine is sourced from PubChem (CID 105034717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).