6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine

C22H22FN7 — CID 91799433

IUPAC6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine
SMILESCc1nc(-c2ccccc2F)c2c(N3CCc4nc(N(C)C)ccc4C3)ncnn12
InChIInChI=1S/C22H22FN7/c1-14-26-20(16-6-4-5-7-17(16)23)21-22(24-13-25-30(14)21)29-11-10-18-15(12-29)8-9-19(27-18)28(2)3/h4-9,13H,10-12H2,1-3H3
InChIKeyDGVFBFRPVFJGKQ-UHFFFAOYSA-N
MW403.47 g/mol
LogP3.26
Rot. Bonds3

About 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine

6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine (PubChem CID 91799433) has the molecular formula C22H22FN7 and a molecular weight of 403.47 g/mol. Its IUPAC name is 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine.

Molecular Properties

Compound Name6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine
PubChem CID91799433
Molecular FormulaC22H22FN7
Molecular Weight403.47 g/mol
Exact Mass403.19
IUPAC Name6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine
SMILESCc1nc(-c2ccccc2F)c2c(N3CCc4nc(N(C)C)ccc4C3)ncnn12
InChIInChI=1S/C22H22FN7/c1-14-26-20(16-6-4-5-7-17(16)23)21-22(24-13-25-30(14)21)29-11-10-18-15(12-29)8-9-19(27-18)28(2)3/h4-9,13H,10-12H2,1-3H3
InChIKeyDGVFBFRPVFJGKQ-UHFFFAOYSA-N
XLogP3.26
TPSA62.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.47
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine?
The IUPAC name of 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine (CID 91799433) is 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine.
What is the SMILES notation for 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine?
The canonical SMILES for 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine is Cc1nc(-c2ccccc2F)c2c(N3CCc4nc(N(C)C)ccc4C3)ncnn12.
What is the InChIKey of 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine?
The InChIKey is DGVFBFRPVFJGKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FN7/c1-14-26-20(16-6-4-5-7-17(16)23)21-22(24-13-25-30(14)21)29-11-10-18-15(12-29)8-9-19(27-18)28(2)3/h4-9,13H,10-12H2,1-3H3.
What are the key properties of 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine?
6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine has a molecular weight of 403.47 g/mol, XLogP of 3.26, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[5-(2-fluorophenyl)-7-methylimidazo[5,1-f][1,2,4]triazin-4-yl]-N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridin-2-amine is sourced from PubChem (CID 91799433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).