2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine

C11H13N3O — CID 83182184

IUPAC2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine
SMILESCc1cnc(C(N)Cc2ccoc2)nc1
InChIInChI=1S/C11H13N3O/c1-8-5-13-11(14-6-8)10(12)4-9-2-3-15-7-9/h2-3,5-7,10H,4,12H2,1H3
InChIKeyMBXDGBZOWFUWNH-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.62
Rot. Bonds3

About 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine

2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine (PubChem CID 83182184) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine
PubChem CID83182184
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine
SMILESCc1cnc(C(N)Cc2ccoc2)nc1
InChIInChI=1S/C11H13N3O/c1-8-5-13-11(14-6-8)10(12)4-9-2-3-15-7-9/h2-3,5-7,10H,4,12H2,1H3
InChIKeyMBXDGBZOWFUWNH-UHFFFAOYSA-N
XLogP1.62
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-3-yl)-1-(5-methyl-3-pyridinyl)ethanamine
CID 105177749
1-(3,5-dichloro-2-pyridinyl)-2-(furan-3-yl)ethanamine
CID 83182559
2-(furan-3-yl)-1-(1H-pyrazol-4-yl)ethanamine
CID 130573296
1-(3-chloro-2-methylphenyl)-2-(furan-3-yl)ethanamine
CID 107103021
2-(furan-3-yl)-1-(4-methoxyphenyl)ethanamine
CID 83175778
4-[1-amino-2-(furan-3-yl)ethyl]-N,N-dimethylaniline
CID 105177745
2-(furan-3-yl)-1-quinolin-5-ylethanamine
CID 105177642
3-(furan-3-yl)-2-methylpropan-1-amine
CID 64666648
2-(furan-3-yl)-1-(2-iodophenyl)ethanamine
CID 105030079
2-(furan-3-yl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105030125
2-(furan-3-yl)-1-(4-methylphenyl)ethanol
CID 11206462
1-(furan-3-yl)propane-2-sulfonamide
CID 150211021

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine?
The IUPAC name of 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine (CID 83182184) is 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine.
What is the SMILES notation for 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine?
The canonical SMILES for 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine is Cc1cnc(C(N)Cc2ccoc2)nc1.
What is the InChIKey of 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine?
The InChIKey is MBXDGBZOWFUWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-8-5-13-11(14-6-8)10(12)4-9-2-3-15-7-9/h2-3,5-7,10H,4,12H2,1H3.
What are the key properties of 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine?
2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine has a molecular weight of 203.25 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-1-(5-methylpyrimidin-2-yl)ethanamine is sourced from PubChem (CID 83182184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).