N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide

C19H24N4O3 — CID 91924469

IUPACN-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1ccc(-c2cnc3n2CC(C(=O)NCCNC(C)=O)CC3)cc1
InChIInChI=1S/C19H24N4O3/c1-13(24)20-9-10-21-19(25)15-5-8-18-22-11-17(23(18)12-15)14-3-6-16(26-2)7-4-14/h3-4,6-7,11,15H,5,8-10,12H2,1-2H3,(H,20,24)(H,21,25)
InChIKeyFERQNKVLCYIFIP-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.37
Rot. Bonds6

About N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide

N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide (PubChem CID 91924469) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
PubChem CID91924469
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
SMILESCOc1ccc(-c2cnc3n2CC(C(=O)NCCNC(C)=O)CC3)cc1
InChIInChI=1S/C19H24N4O3/c1-13(24)20-9-10-21-19(25)15-5-8-18-22-11-17(23(18)12-15)14-3-6-16(26-2)7-4-14/h3-4,6-7,11,15H,5,8-10,12H2,1-2H3,(H,20,24)(H,21,25)
InChIKeyFERQNKVLCYIFIP-UHFFFAOYSA-N
XLogP1.37
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-(4-methoxyphenyl)-N-propyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
CID 91924464
N-(3-ethoxypropyl)-3-thiophen-3-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
CID 91924450
N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-6-carboxamide
CID 155913485
(6S)-N-[[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]methyl]-3-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 97075025
1-[4-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)phenyl]-3-[2-(4-methoxyphenyl)ethyl]urea
CID 71797978
N-[2-(4-methoxyphenoxy)ethyl]cyclopropanecarboxamide
CID 8935452
N-(2-acetamidoethyl)-1-(4-methoxypyrimidin-2-yl)piperidine-4-carboxamide
CID 31895955
N-[2-(4-methoxyphenyl)ethyl]-1-pyrimidin-2-ylpiperidine-3-carboxamide
CID 3223369
N-[2-[2-(4-methoxyphenyl)pyrrol-1-yl]ethyl]acetamide
CID 19095262
N-[2-(4-methoxyphenoxy)ethyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 113005367
N-(2-hydroxyethyl)-1-[2-(4-methoxyphenyl)ethyl]-6-oxopiperidine-3-carboxamide
CID 72920179
N-[2-(4-methoxyphenyl)ethyl]-1-[6-(4-methoxyphenyl)pyrimidin-4-yl]piperidine-3-carboxamide
CID 90519783

Frequently Asked Questions

What is the IUPAC name of N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
The IUPAC name of N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide (CID 91924469) is N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
The canonical SMILES for N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide is COc1ccc(-c2cnc3n2CC(C(=O)NCCNC(C)=O)CC3)cc1.
What is the InChIKey of N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
The InChIKey is FERQNKVLCYIFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c1-13(24)20-9-10-21-19(25)15-5-8-18-22-11-17(23(18)12-15)14-3-6-16(26-2)7-4-14/h3-4,6-7,11,15H,5,8-10,12H2,1-2H3,(H,20,24)(H,21,25).
What are the key properties of N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide?
N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamidoethyl)-3-(4-methoxyphenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide is sourced from PubChem (CID 91924469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).