2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine

C13H16N2O — CID 83175534

IUPAC2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
SMILESCNC(Cc1ccoc1)c1cc(C)ccn1
InChIInChI=1S/C13H16N2O/c1-10-3-5-15-13(7-10)12(14-2)8-11-4-6-16-9-11/h3-7,9,12,14H,8H2,1-2H3
InChIKeyIJDXVAWSAZAILQ-UHFFFAOYSA-N
MW216.28 g/mol
LogP2.49
Rot. Bonds4

About 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine

2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine (PubChem CID 83175534) has the molecular formula C13H16N2O and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
PubChem CID83175534
Molecular FormulaC13H16N2O
Molecular Weight216.28 g/mol
Exact Mass216.13
IUPAC Name2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
SMILESCNC(Cc1ccoc1)c1cc(C)ccn1
InChIInChI=1S/C13H16N2O/c1-10-3-5-15-13(7-10)12(14-2)8-11-4-6-16-9-11/h3-7,9,12,14H,8H2,1-2H3
InChIKeyIJDXVAWSAZAILQ-UHFFFAOYSA-N
XLogP2.49
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,5-dimethylphenyl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
CID 63840680
N-methyl-1-(4-methyl-2-pyridinyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 63840960
2-(5-bromo-3-pyridinyl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
CID 113454942
2-(furan-3-yl)-N-methyl-1-(thiadiazol-4-yl)ethanamine
CID 105177550
N-ethyl-2-(4-methylphenyl)-1-(4-methyl-2-pyridinyl)ethanamine
CID 55259074
1-(4-bromo-3-methylphenyl)-2-(furan-3-yl)-N-methylethanamine
CID 105030035
N,5-dimethyl-1-(4-methyl-2-pyridinyl)hexan-1-amine
CID 83161254
N-ethyl-2-(4-ethylphenyl)-1-(4-methyl-2-pyridinyl)ethanamine
CID 63841394
2-(5-bromo-2-pyridinyl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
CID 104802107
2-(1,3-benzothiazol-2-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine
CID 79818452
2-(furan-3-yl)-N-methyl-1-quinolin-8-ylethanamine
CID 105177547
1-(1,3-dimethylpyrazol-4-yl)-2-(furan-3-yl)-N-methylethanamine
CID 102804370

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine?
The IUPAC name of 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine (CID 83175534) is 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine is CNC(Cc1ccoc1)c1cc(C)ccn1.
What is the InChIKey of 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine?
The InChIKey is IJDXVAWSAZAILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O/c1-10-3-5-15-13(7-10)12(14-2)8-11-4-6-16-9-11/h3-7,9,12,14H,8H2,1-2H3.
What are the key properties of 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine?
2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine has a molecular weight of 216.28 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-N-methyl-1-(4-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 83175534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).