2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol

C11H15N3O2 — CID 65313149

IUPAC2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol
SMILESOCC(CO)NCc1cn2ccccc2n1
InChIInChI=1S/C11H15N3O2/c15-7-10(8-16)12-5-9-6-14-4-2-1-3-11(14)13-9/h1-4,6,10,12,15-16H,5,7-8H2
InChIKeyGTEDVCYNWSXBRA-UHFFFAOYSA-N
MW221.26 g/mol
LogP-0.22
Rot. Bonds5

About 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol

2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol (PubChem CID 65313149) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol.

Molecular Properties

Compound Name2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol
PubChem CID65313149
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol
SMILESOCC(CO)NCc1cn2ccccc2n1
InChIInChI=1S/C11H15N3O2/c15-7-10(8-16)12-5-9-6-14-4-2-1-3-11(14)13-9/h1-4,6,10,12,15-16H,5,7-8H2
InChIKeyGTEDVCYNWSXBRA-UHFFFAOYSA-N
XLogP-0.22
TPSA69.79 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-phenylpropan-1-ol
CID 63261332
(3R)-3-(imidazo[1,2-a]pyridin-2-ylmethylamino)-3-phenylpropan-1-ol
CID 111467271
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-methylpentan-3-amine
CID 61469725
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-methoxy-3-methylbutan-2-amine
CID 65049447
N-(1-hydroxybutan-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
CID 43417878
[1-(imidazo[1,2-a]pyridin-2-ylmethylamino)cyclopropyl]methanol
CID 115762997
ethane;imidazo[1,2-a]pyridin-2-ylmethanol
CID 91126513
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-phenylpropan-2-amine
CID 63011096
1-ethoxy-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-methylbutan-2-amine
CID 103271206
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-2-iodoethanamine
CID 114505443
(1R)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(4-methylphenyl)ethanamine
CID 81348736
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)-N-propylpropanamide
CID 60676900

Frequently Asked Questions

What is the IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol?
The IUPAC name of 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol (CID 65313149) is 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol.
What is the SMILES notation for 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol?
The canonical SMILES for 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol is OCC(CO)NCc1cn2ccccc2n1.
What is the InChIKey of 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol?
The InChIKey is GTEDVCYNWSXBRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-7-10(8-16)12-5-9-6-14-4-2-1-3-11(14)13-9/h1-4,6,10,12,15-16H,5,7-8H2.
What are the key properties of 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol?
2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol has a molecular weight of 221.26 g/mol, XLogP of -0.22, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(imidazo[1,2-a]pyridin-2-ylmethylamino)propane-1,3-diol is sourced from PubChem (CID 65313149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).