N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide

C20H22ClN3O2 — CID 155548717

IUPACN-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCCc1nc2ccc(C)cn2c1C(=O)NCCOc1ccc(Cl)cc1
InChIInChI=1S/C20H22ClN3O2/c1-3-4-17-19(24-13-14(2)5-10-18(24)23-17)20(25)22-11-12-26-16-8-6-15(21)7-9-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,22,25)
InChIKeyALYWJBMLTTYBTN-UHFFFAOYSA-N
MW371.87 g/mol
LogP4.06
Rot. Bonds7

About N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide

N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 155548717) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID155548717
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC NameN-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCCc1nc2ccc(C)cn2c1C(=O)NCCOc1ccc(Cl)cc1
InChIInChI=1S/C20H22ClN3O2/c1-3-4-17-19(24-13-14(2)5-10-18(24)23-17)20(25)22-11-12-26-16-8-6-15(21)7-9-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,22,25)
InChIKeyALYWJBMLTTYBTN-UHFFFAOYSA-N
XLogP4.06
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 675270
6-chloro-N-[[4-[4-(4-chlorophenoxy)-1-piperidyl]phenyl]methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
CID 67401709
7-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]piperazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234668
7-chloro-2-ethyl-N-[[4-[[4-(trifluoromethoxy)phenyl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234745
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]piperazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68235029
(18F)Pbr 111
CID 24944913
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 11675867
2-[2-(4-chlorophenyl)-8-methoxyimidazo[1,2-a]pyridin-3-yl]-N,N-dipropylacetamide
CID 10573035
2-Methyl-imidazo[1,2-a]pyridine-3-carboxylic acid 4-methoxy-benzylamide
CID 1073190
2-(6-chloro-2-(4-(2-fluoroethoxy)phenyl)imidazo(1,2-a)pyridin-3-yl)-N,N-diethylacetamide
CID 24895169
Pbr-111
CID 24895171
6-(aminomethyl)-5-(2,4-dichlorophenyl)-N-(furan-2-ylmethyl)-7-methylimidazo[1,2-a]pyrimidine-2-carboxamide
CID 46900103

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide (CID 155548717) is N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide is CCCc1nc2ccc(C)cn2c1C(=O)NCCOc1ccc(Cl)cc1.
What is the InChIKey of N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is ALYWJBMLTTYBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c1-3-4-17-19(24-13-14(2)5-10-18(24)23-17)20(25)22-11-12-26-16-8-6-15(21)7-9-16/h5-10,13H,3-4,11-12H2,1-2H3,(H,22,25).
What are the key properties of N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide?
N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 371.87 g/mol, XLogP of 4.06, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenoxy)ethyl]-6-methyl-2-propylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 155548717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).