5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol

C13H18ClN3O — CID 107303015

IUPAC5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol
SMILESOCCCCCNCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C13H18ClN3O/c14-11-4-5-13-16-12(10-17(13)9-11)8-15-6-2-1-3-7-18/h4-5,9-10,15,18H,1-3,6-8H2
InChIKeyLOKJSDXEUVRTMP-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.24
Rot. Bonds7

About 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol

5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol (PubChem CID 107303015) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol.

Molecular Properties

Compound Name5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol
PubChem CID107303015
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol
SMILESOCCCCCNCc1cn2cc(Cl)ccc2n1
InChIInChI=1S/C13H18ClN3O/c14-11-4-5-13-16-12(10-17(13)9-11)8-15-6-2-1-3-7-18/h4-5,9-10,15,18H,1-3,6-8H2
InChIKeyLOKJSDXEUVRTMP-UHFFFAOYSA-N
XLogP2.24
TPSA49.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentanamide
CID 106237592
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-5,5,5-trifluoropentan-1-amine
CID 115491273
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-cyclopropylpropan-1-amine
CID 115639536
3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]propanamide
CID 115345098
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 78913138
2-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]ethylurea
CID 83112157
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-propoxypropan-1-amine
CID 82943395
3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]-N-methylpropanamide
CID 78998419
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-3-pyrazol-1-ylpropan-1-amine
CID 115625574
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-methylsulfinylethanamine
CID 115632465
N-tert-butyl-3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]propanamide
CID 115625685
N-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]-2-ethylsulfinylethanamine
CID 115632290

Frequently Asked Questions

What is the IUPAC name of 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol?
The IUPAC name of 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol (CID 107303015) is 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol.
What is the SMILES notation for 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol?
The canonical SMILES for 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol is OCCCCCNCc1cn2cc(Cl)ccc2n1.
What is the InChIKey of 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol?
The InChIKey is LOKJSDXEUVRTMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c14-11-4-5-13-16-12(10-17(13)9-11)8-15-6-2-1-3-7-18/h4-5,9-10,15,18H,1-3,6-8H2.
What are the key properties of 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol?
5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol has a molecular weight of 267.76 g/mol, XLogP of 2.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylamino]pentan-1-ol is sourced from PubChem (CID 107303015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).