N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide

C21H22ClN3O — CID 42737487

IUPACN-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide
SMILESO=C(CCC1CCCC1)Nc1ccc(-c2cn3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C21H22ClN3O/c22-17-8-11-20-24-19(14-25(20)13-17)16-6-9-18(10-7-16)23-21(26)12-5-15-3-1-2-4-15/h6-11,13-15H,1-5,12H2,(H,23,26)
InChIKeyWERYESSABIWCHN-UHFFFAOYSA-N
MW367.88 g/mol
LogP5.56
Rot. Bonds5

About N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide

N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide (PubChem CID 42737487) has the molecular formula C21H22ClN3O and a molecular weight of 367.88 g/mol. Its IUPAC name is N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide.

Molecular Properties

Compound NameN-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide
PubChem CID42737487
Molecular FormulaC21H22ClN3O
Molecular Weight367.88 g/mol
Exact Mass367.15
IUPAC NameN-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide
SMILESO=C(CCC1CCCC1)Nc1ccc(-c2cn3cc(Cl)ccc3n2)cc1
InChIInChI=1S/C21H22ClN3O/c22-17-8-11-20-24-19(14-25(20)13-17)16-6-9-18(10-7-16)23-21(26)12-5-15-3-1-2-4-15/h6-11,13-15H,1-5,12H2,(H,23,26)
InChIKeyWERYESSABIWCHN-UHFFFAOYSA-N
XLogP5.56
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.88
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide?
The IUPAC name of N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide (CID 42737487) is N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide.
What is the SMILES notation for N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide?
The canonical SMILES for N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide is O=C(CCC1CCCC1)Nc1ccc(-c2cn3cc(Cl)ccc3n2)cc1.
What is the InChIKey of N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide?
The InChIKey is WERYESSABIWCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22ClN3O/c22-17-8-11-20-24-19(14-25(20)13-17)16-6-9-18(10-7-16)23-21(26)12-5-15-3-1-2-4-15/h6-11,13-15H,1-5,12H2,(H,23,26).
What are the key properties of N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide?
N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide has a molecular weight of 367.88 g/mol, XLogP of 5.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-chloroimidazo[1,2-a]pyridin-2-yl)phenyl]-3-cyclopentylpropanamide is sourced from PubChem (CID 42737487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).