2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine

C15H13N5O — CID 168772653

IUPAC2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine
SMILESCCOc1ncc2c(-c3ccc4nccn4c3)c[nH]c2n1
InChIInChI=1S/C15H13N5O/c1-2-21-15-18-8-12-11(7-17-14(12)19-15)10-3-4-13-16-5-6-20(13)9-10/h3-9H,2H2,1H3,(H,17,18,19)
InChIKeyMIPNBTMXDOZAKI-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.67
Rot. Bonds3

About 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine

2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine (PubChem CID 168772653) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine.

Molecular Properties

Compound Name2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine
PubChem CID168772653
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC Name2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine
SMILESCCOc1ncc2c(-c3ccc4nccn4c3)c[nH]c2n1
InChIInChI=1S/C15H13N5O/c1-2-21-15-18-8-12-11(7-17-14(12)19-15)10-3-4-13-16-5-6-20(13)9-10/h3-9H,2H2,1H3,(H,17,18,19)
InChIKeyMIPNBTMXDOZAKI-UHFFFAOYSA-N
XLogP2.67
TPSA68.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine?
The IUPAC name of 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine (CID 168772653) is 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine.
What is the SMILES notation for 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine?
The canonical SMILES for 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine is CCOc1ncc2c(-c3ccc4nccn4c3)c[nH]c2n1.
What is the InChIKey of 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine?
The InChIKey is MIPNBTMXDOZAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c1-2-21-15-18-8-12-11(7-17-14(12)19-15)10-3-4-13-16-5-6-20(13)9-10/h3-9H,2H2,1H3,(H,17,18,19).
What are the key properties of 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine?
2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine has a molecular weight of 279.30 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-5-imidazo[1,2-a]pyridin-6-yl-7H-pyrrolo[2,3-d]pyrimidine is sourced from PubChem (CID 168772653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).