8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine

C17H19N7O — CID 143922901

IUPAC8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine
SMILESCOc1cccn2ccnc12.c1nc(N2CCCC2)c2[nH]cnc2n1
InChIInChI=1S/C9H11N5.C8H8N2O/c1-2-4-14(3-1)9-7-8(11-5-10-7)12-6-13-9;1-11-7-3-2-5-10-6-4-9-8(7)10/h5-6H,1-4H2,(H,10,11,12,13);2-6H,1H3
InChIKeyVGFAGYSVKHFLRC-UHFFFAOYSA-N
MW337.39 g/mol
LogP2.30
Rot. Bonds2

About 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine

8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine (PubChem CID 143922901) has the molecular formula C17H19N7O and a molecular weight of 337.39 g/mol. Its IUPAC name is 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine.

Molecular Properties

Compound Name8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine
PubChem CID143922901
Molecular FormulaC17H19N7O
Molecular Weight337.39 g/mol
Exact Mass337.17
IUPAC Name8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine
SMILESCOc1cccn2ccnc12.c1nc(N2CCCC2)c2[nH]cnc2n1
InChIInChI=1S/C9H11N5.C8H8N2O/c1-2-4-14(3-1)9-7-8(11-5-10-7)12-6-13-9;1-11-7-3-2-5-10-6-4-9-8(7)10/h5-6H,1-4H2,(H,10,11,12,13);2-6H,1H3
InChIKeyVGFAGYSVKHFLRC-UHFFFAOYSA-N
XLogP2.30
TPSA84.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.39
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

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1-(8-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)pyrrolidin-3-ol;6-pyrrolidin-1-yl-7H-purine
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CID 62545839
6-[4-(2-methoxyethyl)piperidin-1-yl]-7H-purine
CID 166246145
(3aS,6aR)-3-[(2-methoxyphenyl)methyl]-5-(7H-purin-6-yl)-3a,4,6,6a-tetrahydropyrrolo[3,4-d][1,3]oxazol-2-one
CID 56871667

Frequently Asked Questions

What is the IUPAC name of 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine?
The IUPAC name of 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine (CID 143922901) is 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine.
What is the SMILES notation for 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine?
The canonical SMILES for 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine is COc1cccn2ccnc12.c1nc(N2CCCC2)c2[nH]cnc2n1.
What is the InChIKey of 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine?
The InChIKey is VGFAGYSVKHFLRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5.C8H8N2O/c1-2-4-14(3-1)9-7-8(11-5-10-7)12-6-13-9;1-11-7-3-2-5-10-6-4-9-8(7)10/h5-6H,1-4H2,(H,10,11,12,13);2-6H,1H3.
What are the key properties of 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine?
8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine has a molecular weight of 337.39 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxyimidazo[1,2-a]pyridine;6-pyrrolidin-1-yl-7H-purine is sourced from PubChem (CID 143922901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).