(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine

C15H13ClN2O — CID 79169603

IUPAC(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
SMILESCc1ccc2oc(C(N)c3ccccc3Cl)cc2n1
InChIInChI=1S/C15H13ClN2O/c1-9-6-7-13-12(18-9)8-14(19-13)15(17)10-4-2-3-5-11(10)16/h2-8,15H,17H2,1H3
InChIKeyKCFNOATTWIWBAJ-UHFFFAOYSA-N
MW272.74 g/mol
LogP3.84
Rot. Bonds2

About (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine

(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine (PubChem CID 79169603) has the molecular formula C15H13ClN2O and a molecular weight of 272.74 g/mol. Its IUPAC name is (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine.

Molecular Properties

Compound Name(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
PubChem CID79169603
Molecular FormulaC15H13ClN2O
Molecular Weight272.74 g/mol
Exact Mass272.07
IUPAC Name(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
SMILESCc1ccc2oc(C(N)c3ccccc3Cl)cc2n1
InChIInChI=1S/C15H13ClN2O/c1-9-6-7-13-12(18-9)8-14(19-13)15(17)10-4-2-3-5-11(10)16/h2-8,15H,17H2,1H3
InChIKeyKCFNOATTWIWBAJ-UHFFFAOYSA-N
XLogP3.84
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
The IUPAC name of (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine (CID 79169603) is (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine.
What is the SMILES notation for (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
The canonical SMILES for (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine is Cc1ccc2oc(C(N)c3ccccc3Cl)cc2n1.
What is the InChIKey of (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
The InChIKey is KCFNOATTWIWBAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O/c1-9-6-7-13-12(18-9)8-14(19-13)15(17)10-4-2-3-5-11(10)16/h2-8,15H,17H2,1H3.
What are the key properties of (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine has a molecular weight of 272.74 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine is sourced from PubChem (CID 79169603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).