4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol

C19H14ClN3O2 — CID 155115100

IUPAC4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol
SMILESCOc1cccnc1-c1nc(-c2cc(Cl)ccc2O)n2ccccc12
InChIInChI=1S/C19H14ClN3O2/c1-25-16-6-4-9-21-18(16)17-14-5-2-3-10-23(14)19(22-17)13-11-12(20)7-8-15(13)24/h2-11,24H,1H3
InChIKeyHVJGPXQEZSVCTF-UHFFFAOYSA-N
MW351.79 g/mol
LogP4.43
Rot. Bonds3

About 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol

4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol (PubChem CID 155115100) has the molecular formula C19H14ClN3O2 and a molecular weight of 351.79 g/mol. Its IUPAC name is 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol.

Molecular Properties

Compound Name4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol
PubChem CID155115100
Molecular FormulaC19H14ClN3O2
Molecular Weight351.79 g/mol
Exact Mass351.08
IUPAC Name4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol
SMILESCOc1cccnc1-c1nc(-c2cc(Cl)ccc2O)n2ccccc12
InChIInChI=1S/C19H14ClN3O2/c1-25-16-6-4-9-21-18(16)17-14-5-2-3-10-23(14)19(22-17)13-11-12(20)7-8-15(13)24/h2-11,24H,1H3
InChIKeyHVJGPXQEZSVCTF-UHFFFAOYSA-N
XLogP4.43
TPSA59.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.79
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol?
The IUPAC name of 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol (CID 155115100) is 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol.
What is the SMILES notation for 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol?
The canonical SMILES for 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol is COc1cccnc1-c1nc(-c2cc(Cl)ccc2O)n2ccccc12.
What is the InChIKey of 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol?
The InChIKey is HVJGPXQEZSVCTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN3O2/c1-25-16-6-4-9-21-18(16)17-14-5-2-3-10-23(14)19(22-17)13-11-12(20)7-8-15(13)24/h2-11,24H,1H3.
What are the key properties of 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol?
4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol has a molecular weight of 351.79 g/mol, XLogP of 4.43, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[1-(3-methoxy-2-pyridinyl)imidazo[1,5-a]pyridin-3-yl]phenol is sourced from PubChem (CID 155115100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).