N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide

C20H19FN4O — CID 155525530

IUPACN-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1nc(-c2ccc(F)c(C)c2)c(-c2ccnc(NC(=O)C3CC3)c2)[nH]1
InChIInChI=1S/C20H19FN4O/c1-11-9-14(5-6-16(11)21)18-19(24-12(2)23-18)15-7-8-22-17(10-15)25-20(26)13-3-4-13/h5-10,13H,3-4H2,1-2H3,(H,23,24)(H,22,25,26)
InChIKeyBNOAPQWBXKBDLM-UHFFFAOYSA-N
MW350.40 g/mol
LogP4.24
Rot. Bonds4

About N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide

N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 155525530) has the molecular formula C20H19FN4O and a molecular weight of 350.40 g/mol. Its IUPAC name is N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide
PubChem CID155525530
Molecular FormulaC20H19FN4O
Molecular Weight350.40 g/mol
Exact Mass350.15
IUPAC NameN-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1nc(-c2ccc(F)c(C)c2)c(-c2ccnc(NC(=O)C3CC3)c2)[nH]1
InChIInChI=1S/C20H19FN4O/c1-11-9-14(5-6-16(11)21)18-19(24-12(2)23-18)15-7-8-22-17(10-15)25-20(26)13-3-4-13/h5-10,13H,3-4H2,1-2H3,(H,23,24)(H,22,25,26)
InChIKeyBNOAPQWBXKBDLM-UHFFFAOYSA-N
XLogP4.24
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide (CID 155525530) is N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide is Cc1nc(-c2ccc(F)c(C)c2)c(-c2ccnc(NC(=O)C3CC3)c2)[nH]1.
What is the InChIKey of N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is BNOAPQWBXKBDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O/c1-11-9-14(5-6-16(11)21)18-19(24-12(2)23-18)15-7-8-22-17(10-15)25-20(26)13-3-4-13/h5-10,13H,3-4H2,1-2H3,(H,23,24)(H,22,25,26).
What are the key properties of N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide?
N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 350.40 g/mol, XLogP of 4.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-(4-fluoro-3-methylphenyl)-2-methyl-1H-imidazol-5-yl]-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 155525530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).