3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide

C22H26ClN3O — CID 10500210

IUPAC3-(6-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylpropanamide
SMILESCCCN(CCC)C(=O)CCC1=C(N=C2N1C=C(C=C2)Cl)C3=CC=CC=C3
InChIInChI=1S/C22H26ClN3O/c1-3-14-25(15-4-2)21(27)13-11-19-22(17-8-6-5-7-9-17)24-20-12-10-18(23)16-26(19)20/h5-10,12,16H,3-4,11,13-15H2,1-2H3
InChIKeyQHIABRVJPAWYQN-UHFFFAOYSA-N
MW383.90 g/mol
LogP5.60
Rot. Bonds8

About 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide

3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide (PubChem CID 10500210) has the molecular formula C22H26ClN3O and a molecular weight of 383.90 g/mol. Its IUPAC name is 3-(6-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylpropanamide.

Molecular Properties

Compound Name3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide
PubChem CID10500210
Molecular FormulaC22H26ClN3O
Molecular Weight383.90 g/mol
Exact Mass383.18
IUPAC Name3-(6-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylpropanamide
SMILESCCCN(CCC)C(=O)CCC1=C(N=C2N1C=C(C=C2)Cl)C3=CC=CC=C3
InChIInChI=1S/C22H26ClN3O/c1-3-14-25(15-4-2)21(27)13-11-19-22(17-8-6-5-7-9-17)24-20-12-10-18(23)16-26(19)20/h5-10,12,16H,3-4,11,13-15H2,1-2H3
InChIKeyQHIABRVJPAWYQN-UHFFFAOYSA-N
XLogP5.60
TPSA37.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms27
Complexity462

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.90
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide?
The IUPAC name of 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide (CID 10500210) is 3-(6-chloro-2-phenylimidazo[1,2-a]pyridin-3-yl)-N,N-dipropylpropanamide.
What is the SMILES notation for 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide?
The canonical SMILES for 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide is CCCN(CCC)C(=O)CCC1=C(N=C2N1C=C(C=C2)Cl)C3=CC=CC=C3.
What is the InChIKey of 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide?
The InChIKey is QHIABRVJPAWYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26ClN3O/c1-3-14-25(15-4-2)21(27)13-11-19-22(17-8-6-5-7-9-17)24-20-12-10-18(23)16-26(19)20/h5-10,12,16H,3-4,11,13-15H2,1-2H3.
What are the key properties of 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide?
3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide has a molecular weight of 383.90 g/mol, XLogP of 5.60, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-Chloro-2-phenyl-imidazo[1,2-a]pyridin-3-yl)-N,N-dipropyl-propionamide is sourced from PubChem (CID 10500210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).