(2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine

C15H12F2N2O — CID 79168933

IUPAC(2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
SMILESCc1ccc2oc(C(N)c3ccc(F)cc3F)cc2n1
InChIInChI=1S/C15H12F2N2O/c1-8-2-5-13-12(19-8)7-14(20-13)15(18)10-4-3-9(16)6-11(10)17/h2-7,15H,18H2,1H3
InChIKeyCDVHHUQITUANGS-UHFFFAOYSA-N
MW274.27 g/mol
LogP3.46
Rot. Bonds2

About (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine

(2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine (PubChem CID 79168933) has the molecular formula C15H12F2N2O and a molecular weight of 274.27 g/mol. Its IUPAC name is (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine.

Molecular Properties

Compound Name(2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
PubChem CID79168933
Molecular FormulaC15H12F2N2O
Molecular Weight274.27 g/mol
Exact Mass274.09
IUPAC Name(2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
SMILESCc1ccc2oc(C(N)c3ccc(F)cc3F)cc2n1
InChIInChI=1S/C15H12F2N2O/c1-8-2-5-13-12(19-8)7-14(20-13)15(18)10-4-3-9(16)6-11(10)17/h2-7,15H,18H2,1H3
InChIKeyCDVHHUQITUANGS-UHFFFAOYSA-N
XLogP3.46
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-chlorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
CID 79169603
(2,4-difluorophenyl)-(6-methoxy-1-benzofuran-2-yl)methanamine
CID 61263642
(5-bromothiophen-2-yl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
CID 79169758
1-benzofuran-2-yl-(4-fluoro-2-methylphenyl)methanamine
CID 55182202
(5-bromofuran-2-yl)-(2,4-difluorophenyl)methanamine
CID 43464215
(3-methoxyphenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine
CID 79169677
(2,4-difluorophenyl)-(3,5-dimethylphenyl)methanamine
CID 43197780
(5-fluoro-1-benzofuran-2-yl)-(2-methyl-3-pyridinyl)methanamine
CID 105185794
(4-bromo-2-fluorophenyl)-(5-methyl-1-benzofuran-2-yl)methanamine
CID 82971197
(5-chloro-2-methylphenyl)-(5-fluoro-1-benzofuran-2-yl)methanamine
CID 105046147
(4-fluoro-2-methylphenyl)-(2-methylquinolin-6-yl)methanamine
CID 81270225
(4-bromo-2-methylphenyl)-(5-fluoro-1-benzofuran-2-yl)methanamine
CID 105046089

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
The IUPAC name of (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine (CID 79168933) is (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine.
What is the SMILES notation for (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
The canonical SMILES for (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine is Cc1ccc2oc(C(N)c3ccc(F)cc3F)cc2n1.
What is the InChIKey of (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
The InChIKey is CDVHHUQITUANGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2N2O/c1-8-2-5-13-12(19-8)7-14(20-13)15(18)10-4-3-9(16)6-11(10)17/h2-7,15H,18H2,1H3.
What are the key properties of (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine?
(2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine has a molecular weight of 274.27 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-(5-methylfuro[3,2-b]pyridin-2-yl)methanamine is sourced from PubChem (CID 79168933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).