N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide

C18H16N6O2 — CID 175795176

IUPACN-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cnn(C)c2)c2nc(NC(=O)c3ccncc3)[nH]c12
InChIInChI=1S/C18H16N6O2/c1-24-10-12(9-20-24)13-3-4-14(26-2)16-15(13)21-18(22-16)23-17(25)11-5-7-19-8-6-11/h3-10H,1-2H3,(H2,21,22,23,25)
InChIKeyWAIPZUREDPANIH-UHFFFAOYSA-N
MW348.37 g/mol
LogP2.62
Rot. Bonds4

About N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide

N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide (PubChem CID 175795176) has the molecular formula C18H16N6O2 and a molecular weight of 348.37 g/mol. Its IUPAC name is N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide
PubChem CID175795176
Molecular FormulaC18H16N6O2
Molecular Weight348.37 g/mol
Exact Mass348.13
IUPAC NameN-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide
SMILESCOc1ccc(-c2cnn(C)c2)c2nc(NC(=O)c3ccncc3)[nH]c12
InChIInChI=1S/C18H16N6O2/c1-24-10-12(9-20-24)13-3-4-14(26-2)16-15(13)21-18(22-16)23-17(25)11-5-7-19-8-6-11/h3-10H,1-2H3,(H2,21,22,23,25)
InChIKeyWAIPZUREDPANIH-UHFFFAOYSA-N
XLogP2.62
TPSA97.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.37
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-acetamido-N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]but-2-ynamide
CID 154589238
N-[4-(3,6-dihydro-2H-pyran-4-yl)-7-methoxy-1H-benzimidazol-2-yl]-1-methylpyrazole-4-carboxamide
CID 154589244
4-N-(7-methoxy-4-phenyl-1H-benzimidazol-2-yl)benzene-1,4-dicarboxamide
CID 154973261
4-(2,5-dioxopyrrolidin-1-yl)-N-[4-(4-fluorophenyl)-7-methoxy-1H-benzimidazol-2-yl]benzamide
CID 154589282
N-[3-(1-methylpyrazol-4-yl)phenyl]pyridine-4-carboxamide
CID 110482049
N-[4-methoxy-7-(1-methylpyrazol-4-yl)-3H-indol-2-yl]-4-(pyrrol-1-ylmethyl)benzamide
CID 159978643
N-(4-methoxy-7-phenyl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide
CID 10109223
(E)-N-(3-hydroxy-4-methoxyphenyl)-3-[4-(1-methylpyrazol-4-yl)-3-pyridinyl]prop-2-enamide
CID 126568665
N-[[3-(1-methylpyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methyl]pyridine-4-carboxamide
CID 119104925
N-[(1-methylpyrazol-4-yl)methyl]pyridine-4-carboxamide
CID 35523459
3-(1-methylpyrazol-4-yl)-N-pyridin-4-ylbenzamide
CID 110486276
methyl (E)-3-[4-methoxy-3-(1-methylpyrazol-4-yl)phenyl]but-2-enoate
CID 82543689

Frequently Asked Questions

What is the IUPAC name of N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide?
The IUPAC name of N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide (CID 175795176) is N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide?
The canonical SMILES for N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide is COc1ccc(-c2cnn(C)c2)c2nc(NC(=O)c3ccncc3)[nH]c12.
What is the InChIKey of N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide?
The InChIKey is WAIPZUREDPANIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N6O2/c1-24-10-12(9-20-24)13-3-4-14(26-2)16-15(13)21-18(22-16)23-17(25)11-5-7-19-8-6-11/h3-10H,1-2H3,(H2,21,22,23,25).
What are the key properties of N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide?
N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide has a molecular weight of 348.37 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-methoxy-4-(1-methylpyrazol-4-yl)-1H-benzimidazol-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 175795176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).