3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide

C24H23FN6O2 — CID 134328539

IUPAC3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N(C)C)cn23)c1
InChIInChI=1S/C24H23FN6O2/c1-14-8-20(25)19(23(32)28-17-5-6-17)9-18(14)16-10-27-31(13-16)22-11-26-21-7-4-15(12-30(21)22)24(33)29(2)3/h4,7-13,17H,5-6H2,1-3H3,(H,28,32)
InChIKeyRTEXLTGYXHHFHQ-UHFFFAOYSA-N
MW446.49 g/mol
LogP3.23
Rot. Bonds5

About 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide

3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 134328539) has the molecular formula C24H23FN6O2 and a molecular weight of 446.49 g/mol. Its IUPAC name is 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID134328539
Molecular FormulaC24H23FN6O2
Molecular Weight446.49 g/mol
Exact Mass446.19
IUPAC Name3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide
SMILESCc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N(C)C)cn23)c1
InChIInChI=1S/C24H23FN6O2/c1-14-8-20(25)19(23(32)28-17-5-6-17)9-18(14)16-10-27-31(13-16)22-11-26-21-7-4-15(12-30(21)22)24(33)29(2)3/h4,7-13,17H,5-6H2,1-3H3,(H,28,32)
InChIKeyRTEXLTGYXHHFHQ-UHFFFAOYSA-N
XLogP3.23
TPSA84.53 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.49
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide (CID 134328539) is 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide is Cc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cnc3ccc(C(=O)N(C)C)cn23)c1.
What is the InChIKey of 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is RTEXLTGYXHHFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN6O2/c1-14-8-20(25)19(23(32)28-17-5-6-17)9-18(14)16-10-27-31(13-16)22-11-26-21-7-4-15(12-30(21)22)24(33)29(2)3/h4,7-13,17H,5-6H2,1-3H3,(H,28,32).
What are the key properties of 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide?
3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 446.49 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[5-(cyclopropylcarbamoyl)-4-fluoro-2-methylphenyl]pyrazol-1-yl]-N,N-dimethylimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 134328539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).