4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine

C18H17N3O2 — CID 134806352

IUPAC4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine
SMILESCc1noc(C)c1-c1cnc(Nc2ccccc2)c2c1CCO2
InChIInChI=1S/C18H17N3O2/c1-11-16(12(2)23-21-11)15-10-19-18(17-14(15)8-9-22-17)20-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H,19,20)
InChIKeyJFKYKSRLNCVYSO-UHFFFAOYSA-N
MW307.35 g/mol
LogP4.03
Rot. Bonds3

About 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine

4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine (PubChem CID 134806352) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine
PubChem CID134806352
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine
SMILESCc1noc(C)c1-c1cnc(Nc2ccccc2)c2c1CCO2
InChIInChI=1S/C18H17N3O2/c1-11-16(12(2)23-21-11)15-10-19-18(17-14(15)8-9-22-17)20-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H,19,20)
InChIKeyJFKYKSRLNCVYSO-UHFFFAOYSA-N
XLogP4.03
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The IUPAC name of 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine (CID 134806352) is 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine.
What is the SMILES notation for 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The canonical SMILES for 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine is Cc1noc(C)c1-c1cnc(Nc2ccccc2)c2c1CCO2.
What is the InChIKey of 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
The InChIKey is JFKYKSRLNCVYSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c1-11-16(12(2)23-21-11)15-10-19-18(17-14(15)8-9-22-17)20-13-6-4-3-5-7-13/h3-7,10H,8-9H2,1-2H3,(H,19,20).
What are the key properties of 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine?
4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine has a molecular weight of 307.35 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethyl-1,2-oxazol-4-yl)-N-phenyl-2,3-dihydrofuro[2,3-c]pyridin-7-amine is sourced from PubChem (CID 134806352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).