N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

C23H27Cl2N3O — CID 11189662

IUPACN,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCCCCN(CCCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2ccc(Cl)cn12
InChIInChI=1S/C23H27Cl2N3O/c1-3-5-13-27(14-6-4-2)22(29)15-20-23(17-7-9-18(24)10-8-17)26-21-12-11-19(25)16-28(20)21/h7-12,16H,3-6,13-15H2,1-2H3
InChIKeyHKBISMPXKXOUHD-UHFFFAOYSA-N
MW432.40 g/mol
LogP6.28
Rot. Bonds9

About N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide (PubChem CID 11189662) has the molecular formula C23H27Cl2N3O and a molecular weight of 432.40 g/mol. Its IUPAC name is N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide.

Molecular Properties

Compound NameN,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
PubChem CID11189662
Molecular FormulaC23H27Cl2N3O
Molecular Weight432.40 g/mol
Exact Mass431.15
IUPAC NameN,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCCCCN(CCCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2ccc(Cl)cn12
InChIInChI=1S/C23H27Cl2N3O/c1-3-5-13-27(14-6-4-2)22(29)15-20-23(17-7-9-18(24)10-8-17)26-21-12-11-19(25)16-28(20)21/h7-12,16H,3-6,13-15H2,1-2H3
InChIKeyHKBISMPXKXOUHD-UHFFFAOYSA-N
XLogP6.28
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.40
LogP ≤ 56.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Zolpidem
CID 5732
Alpidem
CID 54897
Saripidem
CID 3058746
CB 34
CID 6603782
2-(4-Chlorophenyl)imidazo(1,2-a)pyridine
CID 745769
2-[6,8-Dibromo-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-N,N-dipropyl-acetamide
CID 10506326
N-Butyl-2-[6,8-dichloro-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-N-methyl-acetamide
CID 11201082
2-[6,8-Dichloro-2-(4-chloro-phenyl)-imidazo[1,2-a]pyridin-3-yl]-N-methyl-N-phenyl-acetamide
CID 11328255
3-(4-Chloro-phenyl)-N-[4-(1H-imidazol-4-yl)-butyl]-3-pyridin-2-yl-propionamide
CID 9800162
1-{3-[6-Chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridine-3-yl]-1-oxopropyl}-4-(phenylmethyl)-4-piperidinol
CID 10142159
3-(4-Chloro-phenyl)-N-[2-(1H-imidazol-4-yl)-ethyl]-N-methyl-3-pyridin-2-yl-propionamide
CID 10270424
6-chloro-N-[[4-(4-chlorophenyl)phenyl]methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
CID 53469216

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The IUPAC name of N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide (CID 11189662) is N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide.
What is the SMILES notation for N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The canonical SMILES for N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide is CCCCN(CCCC)C(=O)Cc1c(-c2ccc(Cl)cc2)nc2ccc(Cl)cn12.
What is the InChIKey of N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
The InChIKey is HKBISMPXKXOUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27Cl2N3O/c1-3-5-13-27(14-6-4-2)22(29)15-20-23(17-7-9-18(24)10-8-17)26-21-12-11-19(25)16-28(20)21/h7-12,16H,3-6,13-15H2,1-2H3.
What are the key properties of N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide?
N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide has a molecular weight of 432.40 g/mol, XLogP of 6.28, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-2-[6-chloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]acetamide is sourced from PubChem (CID 11189662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).