N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine

C12H11N3O2 — CID 103702757

IUPACN-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine
SMILESCc1cc(CNc2nccc3occc23)on1
InChIInChI=1S/C12H11N3O2/c1-8-6-9(17-15-8)7-14-12-10-3-5-16-11(10)2-4-13-12/h2-6H,7H2,1H3,(H,13,14)
InChIKeyMBRFZKFVENBPMH-UHFFFAOYSA-N
MW229.24 g/mol
LogP2.74
Rot. Bonds3

About N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine

N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine (PubChem CID 103702757) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine
PubChem CID103702757
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine
SMILESCc1cc(CNc2nccc3occc23)on1
InChIInChI=1S/C12H11N3O2/c1-8-6-9(17-15-8)7-14-12-10-3-5-16-11(10)2-4-13-12/h2-6H,7H2,1H3,(H,13,14)
InChIKeyMBRFZKFVENBPMH-UHFFFAOYSA-N
XLogP2.74
TPSA64.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine?
The IUPAC name of N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine (CID 103702757) is N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine is Cc1cc(CNc2nccc3occc23)on1.
What is the InChIKey of N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine?
The InChIKey is MBRFZKFVENBPMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-8-6-9(17-15-8)7-14-12-10-3-5-16-11(10)2-4-13-12/h2-6H,7H2,1H3,(H,13,14).
What are the key properties of N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine?
N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine has a molecular weight of 229.24 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 103702757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).