N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide

C18H18ClN3O2 — CID 134139023

IUPACN-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCCOc3ccc(Cl)cc3)c(C)nc2c1
InChIInChI=1S/C18H18ClN3O2/c1-12-7-9-22-16(11-12)21-13(2)17(22)18(23)20-8-10-24-15-5-3-14(19)4-6-15/h3-7,9,11H,8,10H2,1-2H3,(H,20,23)
InChIKeyUYJOZNIHAZCYHX-UHFFFAOYSA-N
MW343.81 g/mol
LogP3.41
Rot. Bonds5

About N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide

N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 134139023) has the molecular formula C18H18ClN3O2 and a molecular weight of 343.81 g/mol. Its IUPAC name is N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID134139023
Molecular FormulaC18H18ClN3O2
Molecular Weight343.81 g/mol
Exact Mass343.11
IUPAC NameN-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccn2c(C(=O)NCCOc3ccc(Cl)cc3)c(C)nc2c1
InChIInChI=1S/C18H18ClN3O2/c1-12-7-9-22-16(11-12)21-13(2)17(22)18(23)20-8-10-24-15-5-3-14(19)4-6-15/h3-7,9,11H,8,10H2,1-2H3,(H,20,23)
InChIKeyUYJOZNIHAZCYHX-UHFFFAOYSA-N
XLogP3.41
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.81
LogP ≤ 53.41
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
N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 11675867
6-chloro-N-(2-methoxyethyl)-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 3201357
2-Methyl-imidazo[1,2-a]pyridine-3-carboxylic acid 4-methoxy-benzylamide
CID 1073190
N-[(3R)-5-chloro-2,3-dihydro-1-benzofuran-3-yl]-6-methoxy-5-(4-methylimidazol-1-yl)pyridine-2-carboxamide
CID 52919035
N-[[4-(4-fluorophenoxy)phenyl]methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 52935300
N-[(4-methoxyphenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 52935516
N-[(3-methoxyphenyl)methyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide
CID 53248893

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide (CID 134139023) is N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccn2c(C(=O)NCCOc3ccc(Cl)cc3)c(C)nc2c1.
What is the InChIKey of N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is UYJOZNIHAZCYHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClN3O2/c1-12-7-9-22-16(11-12)21-13(2)17(22)18(23)20-8-10-24-15-5-3-14(19)4-6-15/h3-7,9,11H,8,10H2,1-2H3,(H,20,23).
What are the key properties of N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide?
N-[2-(4-chlorophenoxy)ethyl]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 343.81 g/mol, XLogP of 3.41, 5 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]-2,7-dimethylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 134139023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).