N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine

C10H12IN3 — CID 114505443

IUPACN-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
SMILESICCNCc1cn2ccccc2n1
InChIInChI=1S/C10H12IN3/c11-4-5-12-7-9-8-14-6-2-1-3-10(14)13-9/h1-3,6,8,12H,4-5,7H2
InChIKeyNUWFWAYHUQSVSJ-UHFFFAOYSA-N
MW301.13 g/mol
LogP1.86
Rot. Bonds4

About N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine (PubChem CID 114505443) has the molecular formula C10H12IN3 and a molecular weight of 301.13 g/mol. Its IUPAC name is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine.

Molecular Properties

Compound NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
PubChem CID114505443
Molecular FormulaC10H12IN3
Molecular Weight301.13 g/mol
Exact Mass301.01
IUPAC NameN-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
SMILESICCNCc1cn2ccccc2n1
InChIInChI=1S/C10H12IN3/c11-4-5-12-7-9-8-14-6-2-1-3-10(14)13-9/h1-3,6,8,12H,4-5,7H2
InChIKeyNUWFWAYHUQSVSJ-UHFFFAOYSA-N
XLogP1.86
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.13
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(imidazo[1,2-a]pyridin-2-ylmethyl)-5-iodopentan-1-amine
CID 107320212
4-bromo-N-(imidazo[1,2-a]pyridin-2-ylmethyl)butan-1-amine
CID 106844928
3-cyclopropyl-N-(imidazo[1,2-a]pyridin-2-ylmethyl)propan-1-amine
CID 115654278
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-7-methyloctan-1-amine
CID 60689918
2-[2-(imidazo[1,2-a]pyridin-2-ylmethylamino)ethoxy]acetamide
CID 106236565
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-(2-methoxyethoxy)propan-1-amine
CID 60698046
4-[(imidazo[1,2-a]pyridin-2-ylmethylamino)methyl]phenol
CID 115572847
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(2-methoxyphenyl)ethanamine
CID 103603783
3-(imidazo[1,2-a]pyridin-2-ylmethylamino)-N-propan-2-ylpropanamide
CID 112688880
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol
CID 65313149
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2,2-dimethoxyethanamine
CID 60687022
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 63000781

Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine?
The IUPAC name of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine (CID 114505443) is N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine.
What is the SMILES notation for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine?
The canonical SMILES for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine is ICCNCc1cn2ccccc2n1.
What is the InChIKey of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine?
The InChIKey is NUWFWAYHUQSVSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12IN3/c11-4-5-12-7-9-8-14-6-2-1-3-10(14)13-9/h1-3,6,8,12H,4-5,7H2.
What are the key properties of N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine?
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine has a molecular weight of 301.13 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine is sourced from PubChem (CID 114505443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).