amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol

C19H17N5O2 — CID 134546506

IUPACamino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol
SMILESCOc1cccc(-c2ncccc2-c2ccc3ncc(C(N)O)n3c2)n1
InChIInChI=1S/C19H17N5O2/c1-26-17-6-2-5-14(23-17)18-13(4-3-9-21-18)12-7-8-16-22-10-15(19(20)25)24(16)11-12/h2-11,19,25H,20H2,1H3
InChIKeyVXLYKEWTEPUTBT-UHFFFAOYSA-N
MW347.38 g/mol
LogP2.42
Rot. Bonds4

About amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol

amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 134546506) has the molecular formula C19H17N5O2 and a molecular weight of 347.38 g/mol. Its IUPAC name is amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

Compound Nameamino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol
PubChem CID134546506
Molecular FormulaC19H17N5O2
Molecular Weight347.38 g/mol
Exact Mass347.14
IUPAC Nameamino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol
SMILESCOc1cccc(-c2ncccc2-c2ccc3ncc(C(N)O)n3c2)n1
InChIInChI=1S/C19H17N5O2/c1-26-17-6-2-5-14(23-17)18-13(4-3-9-21-18)12-7-8-16-22-10-15(19(20)25)24(16)11-12/h2-11,19,25H,20H2,1H3
InChIKeyVXLYKEWTEPUTBT-UHFFFAOYSA-N
XLogP2.42
TPSA98.56 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.38
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol (CID 134546506) is amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol is COc1cccc(-c2ncccc2-c2ccc3ncc(C(N)O)n3c2)n1.
What is the InChIKey of amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is VXLYKEWTEPUTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2/c1-26-17-6-2-5-14(23-17)18-13(4-3-9-21-18)12-7-8-16-22-10-15(19(20)25)24(16)11-12/h2-11,19,25H,20H2,1H3.
What are the key properties of amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol?
amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 347.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for amino-[6-[2-(6-methoxy-2-pyridinyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 134546506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).