N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C23H23N7O2 — CID 129297766

IUPACN-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(N3CCc4nc[nH]c4C3)cc2O1
InChIInChI=1S/C23H23N7O2/c1-23(2)10-14-8-17(28-22(31)15-11-27-30-6-3-5-24-21(15)30)19(9-20(14)32-23)29-7-4-16-18(12-29)26-13-25-16/h3,5-6,8-9,11,13H,4,7,10,12H2,1-2H3,(H,25,26)(H,28,31)
InChIKeySFFMKBRDBLGABL-UHFFFAOYSA-N
MW429.48 g/mol
LogP2.98
Rot. Bonds3

About N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 129297766) has the molecular formula C23H23N7O2 and a molecular weight of 429.48 g/mol. Its IUPAC name is N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID129297766
Molecular FormulaC23H23N7O2
Molecular Weight429.48 g/mol
Exact Mass429.19
IUPAC NameN-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(N3CCc4nc[nH]c4C3)cc2O1
InChIInChI=1S/C23H23N7O2/c1-23(2)10-14-8-17(28-22(31)15-11-27-30-6-3-5-24-21(15)30)19(9-20(14)32-23)29-7-4-16-18(12-29)26-13-25-16/h3,5-6,8-9,11,13H,4,7,10,12H2,1-2H3,(H,25,26)(H,28,31)
InChIKeySFFMKBRDBLGABL-UHFFFAOYSA-N
XLogP2.98
TPSA100.44 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 129297766) is N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is CC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(N3CCc4nc[nH]c4C3)cc2O1.
What is the InChIKey of N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is SFFMKBRDBLGABL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N7O2/c1-23(2)10-14-8-17(28-22(31)15-11-27-30-6-3-5-24-21(15)30)19(9-20(14)32-23)29-7-4-16-18(12-29)26-13-25-16/h3,5-6,8-9,11,13H,4,7,10,12H2,1-2H3,(H,25,26)(H,28,31).
What are the key properties of N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 429.48 g/mol, XLogP of 2.98, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-6-(3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)-3H-1-benzofuran-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 129297766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).