1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one

C24H26ClN5O2 — CID 146720171

IUPAC1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one
SMILESCCc1nc2cc(Cl)ccn2c1C(=O)CCc1ccc2nc(CN3CCOCC3)[nH]c2c1
InChIInChI=1S/C24H26ClN5O2/c1-2-18-24(30-8-7-17(25)14-23(30)28-18)21(31)6-4-16-3-5-19-20(13-16)27-22(26-19)15-29-9-11-32-12-10-29/h3,5,7-8,13-14H,2,4,6,9-12,15H2,1H3,(H,26,27)
InChIKeyRETCYQSMRMRHGR-UHFFFAOYSA-N
MW451.96 g/mol
LogP4.07
Rot. Bonds7

About 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one

1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one (PubChem CID 146720171) has the molecular formula C24H26ClN5O2 and a molecular weight of 451.96 g/mol. Its IUPAC name is 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one.

Molecular Properties

Compound Name1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one
PubChem CID146720171
Molecular FormulaC24H26ClN5O2
Molecular Weight451.96 g/mol
Exact Mass451.18
IUPAC Name1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one
SMILESCCc1nc2cc(Cl)ccn2c1C(=O)CCc1ccc2nc(CN3CCOCC3)[nH]c2c1
InChIInChI=1S/C24H26ClN5O2/c1-2-18-24(30-8-7-17(25)14-23(30)28-18)21(31)6-4-16-3-5-19-20(13-16)27-22(26-19)15-29-9-11-32-12-10-29/h3,5,7-8,13-14H,2,4,6,9-12,15H2,1H3,(H,26,27)
InChIKeyRETCYQSMRMRHGR-UHFFFAOYSA-N
XLogP4.07
TPSA75.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.96
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one?
The IUPAC name of 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one (CID 146720171) is 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one.
What is the SMILES notation for 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one?
The canonical SMILES for 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one is CCc1nc2cc(Cl)ccn2c1C(=O)CCc1ccc2nc(CN3CCOCC3)[nH]c2c1.
What is the InChIKey of 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one?
The InChIKey is RETCYQSMRMRHGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26ClN5O2/c1-2-18-24(30-8-7-17(25)14-23(30)28-18)21(31)6-4-16-3-5-19-20(13-16)27-22(26-19)15-29-9-11-32-12-10-29/h3,5,7-8,13-14H,2,4,6,9-12,15H2,1H3,(H,26,27).
What are the key properties of 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one?
1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one has a molecular weight of 451.96 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-chloro-2-ethylimidazo[1,2-a]pyridin-3-yl)-3-[2-(morpholin-4-ylmethyl)-3H-benzimidazol-5-yl]propan-1-one is sourced from PubChem (CID 146720171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).