N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide

C22H21N5O2 — CID 134328486

IUPACN-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide
SMILESCOc1ccn2c(-n3cc(-c4cc(C(=O)NC5CC5)ccc4C)cn3)cnc2c1
InChIInChI=1S/C22H21N5O2/c1-14-3-4-15(22(28)25-17-5-6-17)9-19(14)16-11-24-27(13-16)21-12-23-20-10-18(29-2)7-8-26(20)21/h3-4,7-13,17H,5-6H2,1-2H3,(H,25,28)
InChIKeyAJITZTZAOKXANN-UHFFFAOYSA-N
MW387.44 g/mol
LogP3.40
Rot. Bonds5

About N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide

N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide (PubChem CID 134328486) has the molecular formula C22H21N5O2 and a molecular weight of 387.44 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide
PubChem CID134328486
Molecular FormulaC22H21N5O2
Molecular Weight387.44 g/mol
Exact Mass387.17
IUPAC NameN-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide
SMILESCOc1ccn2c(-n3cc(-c4cc(C(=O)NC5CC5)ccc4C)cn3)cnc2c1
InChIInChI=1S/C22H21N5O2/c1-14-3-4-15(22(28)25-17-5-6-17)9-19(14)16-11-24-27(13-16)21-12-23-20-10-18(29-2)7-8-26(20)21/h3-4,7-13,17H,5-6H2,1-2H3,(H,25,28)
InChIKeyAJITZTZAOKXANN-UHFFFAOYSA-N
XLogP3.40
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide (CID 134328486) is N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide is COc1ccn2c(-n3cc(-c4cc(C(=O)NC5CC5)ccc4C)cn3)cnc2c1.
What is the InChIKey of N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
The InChIKey is AJITZTZAOKXANN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5O2/c1-14-3-4-15(22(28)25-17-5-6-17)9-19(14)16-11-24-27(13-16)21-12-23-20-10-18(29-2)7-8-26(20)21/h3-4,7-13,17H,5-6H2,1-2H3,(H,25,28).
What are the key properties of N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide has a molecular weight of 387.44 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide is sourced from PubChem (CID 134328486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).