N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine

C14H10BrFN2O — CID 103702617

IUPACN-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine
SMILESFc1ccc(Br)cc1CNc1nccc2occc12
InChIInChI=1S/C14H10BrFN2O/c15-10-1-2-12(16)9(7-10)8-18-14-11-4-6-19-13(11)3-5-17-14/h1-7H,8H2,(H,17,18)
InChIKeyWKKJDCNUGWAPGT-UHFFFAOYSA-N
MW321.15 g/mol
LogP4.34
Rot. Bonds3

About N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine

N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine (PubChem CID 103702617) has the molecular formula C14H10BrFN2O and a molecular weight of 321.15 g/mol. Its IUPAC name is N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine
PubChem CID103702617
Molecular FormulaC14H10BrFN2O
Molecular Weight321.15 g/mol
Exact Mass320.00
IUPAC NameN-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine
SMILESFc1ccc(Br)cc1CNc1nccc2occc12
InChIInChI=1S/C14H10BrFN2O/c15-10-1-2-12(16)9(7-10)8-18-14-11-4-6-19-13(11)3-5-17-14/h1-7H,8H2,(H,17,18)
InChIKeyWKKJDCNUGWAPGT-UHFFFAOYSA-N
XLogP4.34
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.15
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-bromo-2-fluorophenyl)methyl]-1-methylimidazo[4,5-c]pyridin-4-amine
CID 103385485
2-N-[(5-bromo-2-fluorophenyl)methyl]pyrimidine-2,4-diamine
CID 116795672
N'-furo[3,2-c]pyridin-4-ylpropane-1,3-diamine
CID 106535052
N-(1,3-oxazol-4-ylmethyl)furo[3,2-c]pyridin-4-amine
CID 166178354
N-[(3-methyl-1,2-oxazol-5-yl)methyl]furo[3,2-c]pyridin-4-amine
CID 103702757
N-(2-bromoprop-2-enyl)furo[3,2-c]pyridin-4-amine
CID 103702761
5-bromo-4-[(5-bromo-2-fluorophenyl)methylamino]-1H-pyrimidin-6-one
CID 136974694
N-[(5-bromo-2-fluorophenyl)methyl]-4-chlorophthalazin-1-amine
CID 106194292
4-bromo-N-[(5-bromo-2-fluorophenyl)methyl]-2,6-difluoroaniline
CID 65467746
4-N-[(5-bromo-2-fluorophenyl)methyl]quinoline-4,8-diamine
CID 83065691
N-[(5-bromo-2-fluorophenyl)methyl]-6-chloro-5-ethylpyrimidin-4-amine
CID 106194274
2,4-dibromo-N-[(5-bromo-2-fluorophenyl)methyl]aniline
CID 43683047

Frequently Asked Questions

What is the IUPAC name of N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine?
The IUPAC name of N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine (CID 103702617) is N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine is Fc1ccc(Br)cc1CNc1nccc2occc12.
What is the InChIKey of N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine?
The InChIKey is WKKJDCNUGWAPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrFN2O/c15-10-1-2-12(16)9(7-10)8-18-14-11-4-6-19-13(11)3-5-17-14/h1-7H,8H2,(H,17,18).
What are the key properties of N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine?
N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine has a molecular weight of 321.15 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-bromo-2-fluorophenyl)methyl]furo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 103702617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).