8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide

C23H24FN7O2 — CID 155787982

IUPAC8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide
SMILESCc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C(=O)N(C)C)nc23)n(C)n1
InChIInChI=1S/C23H24FN7O2/c1-13-9-19(30(4)28-13)16-11-26-23(31-12-18(27-21(16)31)22(32)29(2)3)25-10-15-14-7-8-33-20(14)6-5-17(15)24/h5-6,9,11-12H,7-8,10H2,1-4H3,(H,25,26)
InChIKeyHXSVXZFLCYWQIO-UHFFFAOYSA-N
MW449.49 g/mol
LogP2.83
Rot. Bonds5

About 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide

8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide (PubChem CID 155787982) has the molecular formula C23H24FN7O2 and a molecular weight of 449.49 g/mol. Its IUPAC name is 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide
PubChem CID155787982
Molecular FormulaC23H24FN7O2
Molecular Weight449.49 g/mol
Exact Mass449.20
IUPAC Name8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide
SMILESCc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C(=O)N(C)C)nc23)n(C)n1
InChIInChI=1S/C23H24FN7O2/c1-13-9-19(30(4)28-13)16-11-26-23(31-12-18(27-21(16)31)22(32)29(2)3)25-10-15-14-7-8-33-20(14)6-5-17(15)24/h5-6,9,11-12H,7-8,10H2,1-4H3,(H,25,26)
InChIKeyHXSVXZFLCYWQIO-UHFFFAOYSA-N
XLogP2.83
TPSA89.58 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.49
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide?
The IUPAC name of 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide (CID 155787982) is 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide.
What is the SMILES notation for 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide?
The canonical SMILES for 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide is Cc1cc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cc(C(=O)N(C)C)nc23)n(C)n1.
What is the InChIKey of 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide?
The InChIKey is HXSVXZFLCYWQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN7O2/c1-13-9-19(30(4)28-13)16-11-26-23(31-12-18(27-21(16)31)22(32)29(2)3)25-10-15-14-7-8-33-20(14)6-5-17(15)24/h5-6,9,11-12H,7-8,10H2,1-4H3,(H,25,26).
What are the key properties of 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide?
8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide has a molecular weight of 449.49 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,5-dimethylpyrazol-3-yl)-5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-N,N-dimethylimidazo[1,2-c]pyrimidine-2-carboxamide is sourced from PubChem (CID 155787982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).