3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide

C18H16ClN3O — CID 90569872

IUPAC3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
SMILESO=C(c1cccc(Cl)c1)N(Cc1cnc2ccccn12)C1CC1
InChIInChI=1S/C18H16ClN3O/c19-14-5-3-4-13(10-14)18(23)22(15-7-8-15)12-16-11-20-17-6-1-2-9-21(16)17/h1-6,9-11,15H,7-8,12H2
InChIKeyUXALOGXKKUUWLJ-UHFFFAOYSA-N
MW325.80 g/mol
LogP3.79
Rot. Bonds4

About 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide

3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide (PubChem CID 90569872) has the molecular formula C18H16ClN3O and a molecular weight of 325.80 g/mol. Its IUPAC name is 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
PubChem CID90569872
Molecular FormulaC18H16ClN3O
Molecular Weight325.80 g/mol
Exact Mass325.10
IUPAC Name3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide
SMILESO=C(c1cccc(Cl)c1)N(Cc1cnc2ccccn12)C1CC1
InChIInChI=1S/C18H16ClN3O/c19-14-5-3-4-13(10-14)18(23)22(15-7-8-15)12-16-11-20-17-6-1-2-9-21(16)17/h1-6,9-11,15H,7-8,12H2
InChIKeyUXALOGXKKUUWLJ-UHFFFAOYSA-N
XLogP3.79
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.80
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
The IUPAC name of 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide (CID 90569872) is 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide is O=C(c1cccc(Cl)c1)N(Cc1cnc2ccccn12)C1CC1.
What is the InChIKey of 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
The InChIKey is UXALOGXKKUUWLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16ClN3O/c19-14-5-3-4-13(10-14)18(23)22(15-7-8-15)12-16-11-20-17-6-1-2-9-21(16)17/h1-6,9-11,15H,7-8,12H2.
What are the key properties of 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide?
3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide has a molecular weight of 325.80 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-cyclopropyl-N-(imidazo[1,2-a]pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 90569872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).