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

C23H23N5O2 — CID 134328580

IUPACN-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide
SMILESCCOc1ccn2c(-n3cc(-c4cc(C(=O)NC5CC5)ccc4C)cn3)cnc2c1
InChIInChI=1S/C23H23N5O2/c1-3-30-19-8-9-27-21(11-19)24-13-22(27)28-14-17(12-25-28)20-10-16(5-4-15(20)2)23(29)26-18-6-7-18/h4-5,8-14,18H,3,6-7H2,1-2H3,(H,26,29)
InChIKeyKVBSGUCWGPKASO-UHFFFAOYSA-N
MW401.47 g/mol
LogP3.79
Rot. Bonds6

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

N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide (PubChem CID 134328580) has the molecular formula C23H23N5O2 and a molecular weight of 401.47 g/mol. Its IUPAC name is N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide
PubChem CID134328580
Molecular FormulaC23H23N5O2
Molecular Weight401.47 g/mol
Exact Mass401.19
IUPAC NameN-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide
SMILESCCOc1ccn2c(-n3cc(-c4cc(C(=O)NC5CC5)ccc4C)cn3)cnc2c1
InChIInChI=1S/C23H23N5O2/c1-3-30-19-8-9-27-21(11-19)24-13-22(27)28-14-17(12-25-28)20-10-16(5-4-15(20)2)23(29)26-18-6-7-18/h4-5,8-14,18H,3,6-7H2,1-2H3,(H,26,29)
InChIKeyKVBSGUCWGPKASO-UHFFFAOYSA-N
XLogP3.79
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.47
LogP ≤ 53.79
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-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
The IUPAC name of N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide (CID 134328580) is N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide.
What is the SMILES notation for N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
The canonical SMILES for N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide is CCOc1ccn2c(-n3cc(-c4cc(C(=O)NC5CC5)ccc4C)cn3)cnc2c1.
What is the InChIKey of N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
The InChIKey is KVBSGUCWGPKASO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2/c1-3-30-19-8-9-27-21(11-19)24-13-22(27)28-14-17(12-25-28)20-10-16(5-4-15(20)2)23(29)26-18-6-7-18/h4-5,8-14,18H,3,6-7H2,1-2H3,(H,26,29).
What are the key properties of N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide?
N-cyclopropyl-3-[1-(7-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide has a molecular weight of 401.47 g/mol, XLogP of 3.79, 6 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-ethoxyimidazo[1,2-a]pyridin-3-yl)pyrazol-4-yl]-4-methylbenzamide is sourced from PubChem (CID 134328580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).