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

C11H10N2O2 — CID 104789356

IUPAC(2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone
SMILESCc1occc1C(=O)c1cccnc1N
InChIInChI=1S/C11H10N2O2/c1-7-8(4-6-15-7)10(14)9-3-2-5-13-11(9)12/h2-6H,1H3,(H2,12,13)
InChIKeyKMBLLIJEAMCBNC-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.80
Rot. Bonds2

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

(2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone (PubChem CID 104789356) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone.

Molecular Properties

Compound Name(2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone
PubChem CID104789356
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name(2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone
SMILESCc1occc1C(=O)c1cccnc1N
InChIInChI=1S/C11H10N2O2/c1-7-8(4-6-15-7)10(14)9-3-2-5-13-11(9)12/h2-6H,1H3,(H2,12,13)
InChIKeyKMBLLIJEAMCBNC-UHFFFAOYSA-N
XLogP1.80
TPSA69.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone?
The IUPAC name of (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone (CID 104789356) is (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone.
What is the SMILES notation for (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone?
The canonical SMILES for (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone is Cc1occc1C(=O)c1cccnc1N.
What is the InChIKey of (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone?
The InChIKey is KMBLLIJEAMCBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-8(4-6-15-7)10(14)9-3-2-5-13-11(9)12/h2-6H,1H3,(H2,12,13).
What are the key properties of (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone?
(2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone has a molecular weight of 202.21 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-pyridinyl)-(2-methylfuran-3-yl)methanone is sourced from PubChem (CID 104789356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).