2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile

C18H14FN3O — CID 665521

IUPAC2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile
SMILESCc1ccc(-c2c(C)c(-c3ccc(F)cc3)nc(N)c2C#N)o1
InChIInChI=1S/C18H14FN3O/c1-10-3-8-15(23-10)16-11(2)17(22-18(21)14(16)9-20)12-4-6-13(19)7-5-12/h3-8H,1-2H3,(H2,21,22)
InChIKeyDYXJANZWCBWYFL-UHFFFAOYSA-N
MW307.33 g/mol
LogP4.22
Rot. Bonds2

About 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile

2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile (PubChem CID 665521) has the molecular formula C18H14FN3O and a molecular weight of 307.33 g/mol. Its IUPAC name is 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile
PubChem CID665521
Molecular FormulaC18H14FN3O
Molecular Weight307.33 g/mol
Exact Mass307.11
IUPAC Name2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile
SMILESCc1ccc(-c2c(C)c(-c3ccc(F)cc3)nc(N)c2C#N)o1
InChIInChI=1S/C18H14FN3O/c1-10-3-8-15(23-10)16-11(2)17(22-18(21)14(16)9-20)12-4-6-13(19)7-5-12/h3-8H,1-2H3,(H2,21,22)
InChIKeyDYXJANZWCBWYFL-UHFFFAOYSA-N
XLogP4.22
TPSA75.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-4-(2-furyl)-6-phenylnicotinonitrile
CID 743242
2-Amino-4-(5-methylfuran-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 679296
2-amino-4-(5-methyl-2-furyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
CID 2047114
2-Amino-6-furan-2-yl-4-phenyl-nicotinonitrile
CID 24950370
MAP Kinase Inhibitor, 2
CID 3399382
N-[3-cyano-4-(furan-2-yl)-6-phenylpyridin-2-yl]acetamide
CID 671422
2-Amino-4-(5-methyl-2-furyl)-6-phenylnicotinonitrile
CID 3355257
2-Amino-6-cyclopropyl-4-(furan-2-yl)pyridine-3-carbonitrile
CID 659053
2-Amino-6-(5-methylfuran-2-yl)-4-(4-methylphenyl)pyridine-3-carbonitrile
CID 661059
2-Amino-4-(4-fluorophenyl)-6-(5-methylfuran-2-yl)pyridine-3-carbonitrile
CID 705445
2-Amino-5-ethyl-4-(2-furanyl)-6-propyl-3-pyridinecarbonitrile
CID 748950
2-amino-4-(2-furyl)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridine-3-carbonitrile
CID 754321

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile (CID 665521) is 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile is Cc1ccc(-c2c(C)c(-c3ccc(F)cc3)nc(N)c2C#N)o1.
What is the InChIKey of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile?
The InChIKey is DYXJANZWCBWYFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O/c1-10-3-8-15(23-10)16-11(2)17(22-18(21)14(16)9-20)12-4-6-13(19)7-5-12/h3-8H,1-2H3,(H2,21,22).
What are the key properties of 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile?
2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile has a molecular weight of 307.33 g/mol, XLogP of 4.22, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(4-fluorophenyl)-5-methyl-4-(5-methylfuran-2-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 665521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).