4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine

C12H17N3O — CID 82146556

IUPAC4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine
SMILESCc1cn2cccc(OCCCCN)c2n1
InChIInChI=1S/C12H17N3O/c1-10-9-15-7-4-5-11(12(15)14-10)16-8-3-2-6-13/h4-5,7,9H,2-3,6,8,13H2,1H3
InChIKeyPTPMIBYXIPWTSF-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.76
Rot. Bonds5

About 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine

4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine (PubChem CID 82146556) has the molecular formula C12H17N3O and a molecular weight of 219.29 g/mol. Its IUPAC name is 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine.

Molecular Properties

Compound Name4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine
PubChem CID82146556
Molecular FormulaC12H17N3O
Molecular Weight219.29 g/mol
Exact Mass219.14
IUPAC Name4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine
SMILESCc1cn2cccc(OCCCCN)c2n1
InChIInChI=1S/C12H17N3O/c1-10-9-15-7-4-5-11(12(15)14-10)16-8-3-2-6-13/h4-5,7,9H,2-3,6,8,13H2,1H3
InChIKeyPTPMIBYXIPWTSF-UHFFFAOYSA-N
XLogP1.76
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.76
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

2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyethanol
CID 82147143
4-[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyethoxy]aniline
CID 82147716
8-[(2-methoxyphenyl)methoxy]-2-methylimidazo[1,2-a]pyridine
CID 21286352
3-[2-(aminomethyl)imidazo[1,2-a]pyridin-8-yl]oxy-N,N-dimethylpropan-1-amine
CID 82055923
[8-(3-phenoxypropoxy)imidazo[1,2-a]pyridin-2-yl]methanamine
CID 82055913
5-butylidene-3-[4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutyl]-1,3-thiazolidine-2,4-dione
CID 57040647
(5E)-5-butylidene-3-[4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutyl]-1,3-thiazolidine-2,4-dione
CID 18936750
1-[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]piperidin-4-one
CID 110498338
1-(azepan-1-yl)-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyethanone
CID 110498271
N-butyl-N-ethyl-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110498290
3-hydroxy-2-[[2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetyl]amino]butanoic acid
CID 110496815
N-[(4-chlorophenyl)methyl]-2-(2-methylimidazo[1,2-a]pyridin-8-yl)oxyacetamide
CID 110496827

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine?
The IUPAC name of 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine (CID 82146556) is 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine.
What is the SMILES notation for 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine?
The canonical SMILES for 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine is Cc1cn2cccc(OCCCCN)c2n1.
What is the InChIKey of 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine?
The InChIKey is PTPMIBYXIPWTSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O/c1-10-9-15-7-4-5-11(12(15)14-10)16-8-3-2-6-13/h4-5,7,9H,2-3,6,8,13H2,1H3.
What are the key properties of 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine?
4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine has a molecular weight of 219.29 g/mol, XLogP of 1.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylimidazo[1,2-a]pyridin-8-yl)oxybutan-1-amine is sourced from PubChem (CID 82146556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).