N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide

C14H19N3O3 — CID 110022295

IUPACN-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc2ncc(C(=O)NCCCOCCO)n2c1
InChIInChI=1S/C14H19N3O3/c1-11-3-4-13-16-9-12(17(13)10-11)14(19)15-5-2-7-20-8-6-18/h3-4,9-10,18H,2,5-8H2,1H3,(H,15,19)
InChIKeyMQHSPUUVQSNHEM-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.77
Rot. Bonds7

About N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide

N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 110022295) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID110022295
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC NameN-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc2ncc(C(=O)NCCCOCCO)n2c1
InChIInChI=1S/C14H19N3O3/c1-11-3-4-13-16-9-12(17(13)10-11)14(19)15-5-2-7-20-8-6-18/h3-4,9-10,18H,2,5-8H2,1H3,(H,15,19)
InChIKeyMQHSPUUVQSNHEM-UHFFFAOYSA-N
XLogP0.77
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.77
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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Frequently Asked Questions

What is the IUPAC name of N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 110022295) is N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc2ncc(C(=O)NCCCOCCO)n2c1.
What is the InChIKey of N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is MQHSPUUVQSNHEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-11-3-4-13-16-9-12(17(13)10-11)14(19)15-5-2-7-20-8-6-18/h3-4,9-10,18H,2,5-8H2,1H3,(H,15,19).
What are the key properties of N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide?
N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 277.32 g/mol, XLogP of 0.77, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-hydroxyethoxy)propyl]-6-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 110022295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).