[4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol

C19H20ClN3O2 — CID 140914374

IUPAC[4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(N4CCCC4)cc3n2)cc1Cl
InChIInChI=1S/C19H20ClN3O2/c1-25-18-8-13(12-24)15(10-16(18)20)17-11-23-7-4-14(9-19(23)21-17)22-5-2-3-6-22/h4,7-11,24H,2-3,5-6,12H2,1H3
InChIKeyOXIZANWHLFEAJL-UHFFFAOYSA-N
MW357.84 g/mol
LogP3.76
Rot. Bonds4

About [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol

[4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol (PubChem CID 140914374) has the molecular formula C19H20ClN3O2 and a molecular weight of 357.84 g/mol. Its IUPAC name is [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol.

Molecular Properties

Compound Name[4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
PubChem CID140914374
Molecular FormulaC19H20ClN3O2
Molecular Weight357.84 g/mol
Exact Mass357.12
IUPAC Name[4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
SMILESCOc1cc(CO)c(-c2cn3ccc(N4CCCC4)cc3n2)cc1Cl
InChIInChI=1S/C19H20ClN3O2/c1-25-18-8-13(12-24)15(10-16(18)20)17-11-23-7-4-14(9-19(23)21-17)22-5-2-3-6-22/h4,7-11,24H,2-3,5-6,12H2,1H3
InChIKeyOXIZANWHLFEAJL-UHFFFAOYSA-N
XLogP3.76
TPSA50.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.84
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
The IUPAC name of [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol (CID 140914374) is [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol.
What is the SMILES notation for [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
The canonical SMILES for [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol is COc1cc(CO)c(-c2cn3ccc(N4CCCC4)cc3n2)cc1Cl.
What is the InChIKey of [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
The InChIKey is OXIZANWHLFEAJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN3O2/c1-25-18-8-13(12-24)15(10-16(18)20)17-11-23-7-4-14(9-19(23)21-17)22-5-2-3-6-22/h4,7-11,24H,2-3,5-6,12H2,1H3.
What are the key properties of [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol?
[4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol has a molecular weight of 357.84 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-5-methoxy-2-(7-pyrrolidin-1-ylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol is sourced from PubChem (CID 140914374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).