(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine

C15H15N3O — CID 81400826

IUPAC(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine
SMILESC[C@@H](NCc1cnc2ccccc2n1)c1ccco1
InChIInChI=1S/C15H15N3O/c1-11(15-7-4-8-19-15)16-9-12-10-17-13-5-2-3-6-14(13)18-12/h2-8,10-11,16H,9H2,1H3/t11-/m1/s1
InChIKeyIQELFXMUYBJECV-LLVKDONJSA-N
MW253.31 g/mol
LogP3.07
Rot. Bonds4

About (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine

(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine (PubChem CID 81400826) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine
PubChem CID81400826
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine
SMILESC[C@@H](NCc1cnc2ccccc2n1)c1ccco1
InChIInChI=1S/C15H15N3O/c1-11(15-7-4-8-19-15)16-9-12-10-17-13-5-2-3-6-14(13)18-12/h2-8,10-11,16H,9H2,1H3/t11-/m1/s1
InChIKeyIQELFXMUYBJECV-LLVKDONJSA-N
XLogP3.07
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1S)-1-(2-methylphenyl)-N-(quinoxalin-2-ylmethyl)ethanamine
CID 81363891
1-(5-methyl-1,3-oxazol-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine
CID 106388068
1-(2-bromophenyl)-N-(quinoxalin-2-ylmethyl)ethanamine
CID 43780222
1-(3-fluorophenyl)-N-(quinoxalin-2-ylmethyl)ethanamine
CID 43770212
(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 81401203
2-methyl-N-(quinoxalin-2-ylmethyl)-1-thiophen-2-ylpropan-1-amine
CID 43786598
N-(quinoxalin-2-ylmethyl)hexan-2-amine
CID 55050397
(1R)-1-(furan-2-yl)-N-[(6-methoxy-2-pyridinyl)methyl]ethanamine
CID 81399782
1-(furan-2-yl)-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 43234418
(1R)-1-(furan-2-yl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 82867029
(1S)-1-(furan-2-yl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]ethanamine
CID 81403640
1-(furan-2-yl)-N-(1,3-thiazol-5-ylmethyl)ethanamine
CID 62758862

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine?
The IUPAC name of (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine (CID 81400826) is (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine.
What is the SMILES notation for (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine?
The canonical SMILES for (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine is C[C@@H](NCc1cnc2ccccc2n1)c1ccco1.
What is the InChIKey of (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine?
The InChIKey is IQELFXMUYBJECV-LLVKDONJSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11(15-7-4-8-19-15)16-9-12-10-17-13-5-2-3-6-14(13)18-12/h2-8,10-11,16H,9H2,1H3/t11-/m1/s1.
What are the key properties of (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine?
(1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine has a molecular weight of 253.31 g/mol, XLogP of 3.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(furan-2-yl)-N-(quinoxalin-2-ylmethyl)ethanamine is sourced from PubChem (CID 81400826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).