(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine

C12H15NO2 — CID 81402622

IUPAC(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
SMILESCc1ccc(CN[C@H](C)c2ccco2)o1
InChIInChI=1S/C12H15NO2/c1-9-5-6-11(15-9)8-13-10(2)12-4-3-7-14-12/h3-7,10,13H,8H2,1-2H3/t10-/m1/s1
InChIKeyMPCGCJUVZCPYRG-SNVBAGLBSA-N
MW205.26 g/mol
LogP3.03
Rot. Bonds4

About (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine

(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine (PubChem CID 81402622) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
PubChem CID81402622
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
SMILESCc1ccc(CN[C@H](C)c2ccco2)o1
InChIInChI=1S/C12H15NO2/c1-9-5-6-11(15-9)8-13-10(2)12-4-3-7-14-12/h3-7,10,13H,8H2,1-2H3/t10-/m1/s1
InChIKeyMPCGCJUVZCPYRG-SNVBAGLBSA-N
XLogP3.03
TPSA38.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-N-[(5-ethylfuran-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 81403007
N-[(5-ethylfuran-2-yl)methyl]-1-(furan-2-yl)ethanamine
CID 62346680
(1S)-N-(furan-2-ylmethyl)-1-(5-methylfuran-2-yl)ethanamine
CID 30111067
(1R)-N-(1-benzofuran-2-ylmethyl)-1-(furan-2-yl)ethanamine
CID 81403388
N-[(5-methylfuran-2-yl)methyl]-1-(3-methylpyrazin-2-yl)ethanamine
CID 114080332
(1S)-1-(furan-2-yl)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 107914769
N-[(5-methylfuran-2-yl)methyl]-1-(3-methylphenyl)ethanamine
CID 55081693
1-(furan-2-yl)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 103605606
(1R)-1-(furan-2-yl)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]ethanamine
CID 107914770
1-(2-bromophenyl)-N-[(5-methylfuran-2-yl)methyl]ethanamine
CID 43223395
methyl 5-[[[(1R)-1-(furan-2-yl)ethyl]amino]methyl]-2-methylfuran-3-carboxylate
CID 81400076
1-(furan-2-yl)-N-[(3-methylphenyl)methyl]ethanamine
CID 43181990

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine?
The IUPAC name of (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine (CID 81402622) is (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine.
What is the SMILES notation for (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine?
The canonical SMILES for (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine is Cc1ccc(CN[C@H](C)c2ccco2)o1.
What is the InChIKey of (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine?
The InChIKey is MPCGCJUVZCPYRG-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H15NO2/c1-9-5-6-11(15-9)8-13-10(2)12-4-3-7-14-12/h3-7,10,13H,8H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine?
(1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine has a molecular weight of 205.26 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-N-[(5-methylfuran-2-yl)methyl]ethanamine is sourced from PubChem (CID 81402622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).