6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine

C17H18ClN5O — CID 134284325

IUPAC6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1Cl
InChIInChI=1S/C17H18ClN5O/c1-24-15-7-17-20-9-14(23(17)10-12(15)18)13-3-2-4-16(22-13)21-11-5-6-19-8-11/h2-4,7,9-11,19H,5-6,8H2,1H3,(H,21,22)
InChIKeyICTMRLXOZACTIZ-UHFFFAOYSA-N
MW343.82 g/mol
LogP2.83
Rot. Bonds4

About 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine

6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine (PubChem CID 134284325) has the molecular formula C17H18ClN5O and a molecular weight of 343.82 g/mol. Its IUPAC name is 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine.

Molecular Properties

Compound Name6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
PubChem CID134284325
Molecular FormulaC17H18ClN5O
Molecular Weight343.82 g/mol
Exact Mass343.12
IUPAC Name6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine
SMILESCOc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1Cl
InChIInChI=1S/C17H18ClN5O/c1-24-15-7-17-20-9-14(23(17)10-12(15)18)13-3-2-4-16(22-13)21-11-5-6-19-8-11/h2-4,7,9-11,19H,5-6,8H2,1H3,(H,21,22)
InChIKeyICTMRLXOZACTIZ-UHFFFAOYSA-N
XLogP2.83
TPSA63.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.82
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
The IUPAC name of 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine (CID 134284325) is 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine.
What is the SMILES notation for 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
The canonical SMILES for 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine is COc1cc2ncc(-c3cccc(NC4CCNC4)n3)n2cc1Cl.
What is the InChIKey of 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
The InChIKey is ICTMRLXOZACTIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN5O/c1-24-15-7-17-20-9-14(23(17)10-12(15)18)13-3-2-4-16(22-13)21-11-5-6-19-8-11/h2-4,7,9-11,19H,5-6,8H2,1H3,(H,21,22).
What are the key properties of 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine?
6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine has a molecular weight of 343.82 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-chloro-7-methoxyimidazo[1,2-a]pyridin-3-yl)-N-pyrrolidin-3-ylpyridin-2-amine is sourced from PubChem (CID 134284325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).