2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine

C12H14N2O2 — CID 68695556

IUPAC2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine
SMILESNc1ccnc2oc(C[C@@H]3CCCO3)cc12
InChIInChI=1S/C12H14N2O2/c13-11-3-4-14-12-10(11)7-9(16-12)6-8-2-1-5-15-8/h3-4,7-8H,1-2,5-6H2,(H2,13,14)/t8-/m0/s1
InChIKeyRGNAJUWJVOGAQL-QMMMGPOBSA-N
MW218.26 g/mol
LogP2.13
Rot. Bonds2

About 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine

2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine (PubChem CID 68695556) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine.

Molecular Properties

Compound Name2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine
PubChem CID68695556
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine
SMILESNc1ccnc2oc(C[C@@H]3CCCO3)cc12
InChIInChI=1S/C12H14N2O2/c13-11-3-4-14-12-10(11)7-9(16-12)6-8-2-1-5-15-8/h3-4,7-8H,1-2,5-6H2,(H2,13,14)/t8-/m0/s1
InChIKeyRGNAJUWJVOGAQL-QMMMGPOBSA-N
XLogP2.13
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine?
The IUPAC name of 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine (CID 68695556) is 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine.
What is the SMILES notation for 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine?
The canonical SMILES for 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine is Nc1ccnc2oc(C[C@@H]3CCCO3)cc12.
What is the InChIKey of 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine?
The InChIKey is RGNAJUWJVOGAQL-QMMMGPOBSA-N. The full InChI is InChI=1S/C12H14N2O2/c13-11-3-4-14-12-10(11)7-9(16-12)6-8-2-1-5-15-8/h3-4,7-8H,1-2,5-6H2,(H2,13,14)/t8-/m0/s1.
What are the key properties of 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine?
2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine has a molecular weight of 218.26 g/mol, XLogP of 2.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2S)-oxolan-2-yl]methyl]furo[2,3-b]pyridin-4-amine is sourced from PubChem (CID 68695556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).