N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine

C11H14ClN3 — CID 115591883

IUPACN-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
SMILESCCCNCc1c(Cl)nc2ccccn12
InChIInChI=1S/C11H14ClN3/c1-2-6-13-8-9-11(12)14-10-5-3-4-7-15(9)10/h3-5,7,13H,2,6,8H2,1H3
InChIKeyVLOVLMXYPVVIMY-UHFFFAOYSA-N
MW223.71 g/mol
LogP2.49
Rot. Bonds4

About N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine

N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine (PubChem CID 115591883) has the molecular formula C11H14ClN3 and a molecular weight of 223.71 g/mol. Its IUPAC name is N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
PubChem CID115591883
Molecular FormulaC11H14ClN3
Molecular Weight223.71 g/mol
Exact Mass223.09
IUPAC NameN-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
SMILESCCCNCc1c(Cl)nc2ccccn12
InChIInChI=1S/C11H14ClN3/c1-2-6-13-8-9-11(12)14-10-5-3-4-7-15(9)10/h3-5,7,13H,2,6,8H2,1H3
InChIKeyVLOVLMXYPVVIMY-UHFFFAOYSA-N
XLogP2.49
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.71
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2-chloroimidazo[1,2-a]pyridin-3-yl)-N-propylprop-2-en-1-amine
CID 79348237
N-methyl-N-pentyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
CID 43478478
2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]ethanol
CID 54879446
N-[(2-pyrimidin-2-ylsulfanylimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine
CID 63805663
N-[[2-(2-methylimidazol-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
CID 43478576
2-[methyl-[3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-yl]amino]acetamide
CID 43478504
N-(3-methoxypropyl)-N-methyl-3-(propylaminomethyl)imidazo[1,2-a]pyridin-2-amine
CID 63010016
2-(propylaminomethyl)pyrido[1,2-a]pyrimidin-4-one
CID 60671768
N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]-1-[(2R)-4-ethylmorpholin-2-yl]methanamine
CID 95345643
3-[[(2-chloroimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]cyclohexan-1-ol
CID 111467503
2-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methylamino]-1-(5-chlorothiophen-2-yl)ethanol
CID 111469544
N-[[2-(3-methoxypyrrolidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]propan-1-amine
CID 103535779

Frequently Asked Questions

What is the IUPAC name of N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine?
The IUPAC name of N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine (CID 115591883) is N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine?
The canonical SMILES for N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine is CCCNCc1c(Cl)nc2ccccn12.
What is the InChIKey of N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine?
The InChIKey is VLOVLMXYPVVIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3/c1-2-6-13-8-9-11(12)14-10-5-3-4-7-15(9)10/h3-5,7,13H,2,6,8H2,1H3.
What are the key properties of N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine?
N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine has a molecular weight of 223.71 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chloroimidazo[1,2-a]pyridin-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 115591883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).