(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol

C11H12N2O2 — CID 104800648

IUPAC(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol
SMILESCc1ccoc1C(O)c1cccnc1N
InChIInChI=1S/C11H12N2O2/c1-7-4-6-15-10(7)9(14)8-3-2-5-13-11(8)12/h2-6,9,14H,1H3,(H2,12,13)
InChIKeyNQEXIXBACIRMAS-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.65
Rot. Bonds2

About (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol

(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol (PubChem CID 104800648) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol.

Molecular Properties

Compound Name(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol
PubChem CID104800648
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol
SMILESCc1ccoc1C(O)c1cccnc1N
InChIInChI=1S/C11H12N2O2/c1-7-4-6-15-10(7)9(14)8-3-2-5-13-11(8)12/h2-6,9,14H,1H3,(H2,12,13)
InChIKeyNQEXIXBACIRMAS-UHFFFAOYSA-N
XLogP1.65
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol?
The IUPAC name of (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol (CID 104800648) is (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol.
What is the SMILES notation for (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol?
The canonical SMILES for (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol is Cc1ccoc1C(O)c1cccnc1N.
What is the InChIKey of (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol?
The InChIKey is NQEXIXBACIRMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-7-4-6-15-10(7)9(14)8-3-2-5-13-11(8)12/h2-6,9,14H,1H3,(H2,12,13).
What are the key properties of (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol?
(2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol has a molecular weight of 204.23 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-pyridinyl)-(3-methylfuran-2-yl)methanol is sourced from PubChem (CID 104800648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).