4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine

C17H14N4O2 — CID 155753624

IUPAC4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine
SMILESCOc1cccc(-c2nc(-c3ccc(C)o3)nc3[nH]ccc23)n1
InChIInChI=1S/C17H14N4O2/c1-10-6-7-13(23-10)17-20-15(11-8-9-18-16(11)21-17)12-4-3-5-14(19-12)22-2/h3-9H,1-2H3,(H,18,20,21)
InChIKeyVLVLKUSXQKRCRH-UHFFFAOYSA-N
MW306.33 g/mol
LogP3.60
Rot. Bonds3

About 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine

4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine (PubChem CID 155753624) has the molecular formula C17H14N4O2 and a molecular weight of 306.33 g/mol. Its IUPAC name is 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine
PubChem CID155753624
Molecular FormulaC17H14N4O2
Molecular Weight306.33 g/mol
Exact Mass306.11
IUPAC Name4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine
SMILESCOc1cccc(-c2nc(-c3ccc(C)o3)nc3[nH]ccc23)n1
InChIInChI=1S/C17H14N4O2/c1-10-6-7-13(23-10)17-20-15(11-8-9-18-16(11)21-17)12-4-3-5-14(19-12)22-2/h3-9H,1-2H3,(H,18,20,21)
InChIKeyVLVLKUSXQKRCRH-UHFFFAOYSA-N
XLogP3.60
TPSA76.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(6-methyl-2-pyridinyl)-4-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidine
CID 68935386
4-(3,4-dihydro-2H-pyran-5-yl)-2-(6-methyl-2-pyridinyl)-7H-pyrrolo[2,3-d]pyrimidine
CID 174613988
6-methoxy-N-[2-methyl-5-(5-methylfuran-2-yl)phenyl]pyridine-2-sulfonamide
CID 67283168
2-(4-methoxyphenyl)-5-methylfuran
CID 11171456
4-chloro-5-methyl-2-(5-methylfuran-2-yl)-6-phenylpyrimidine
CID 104845868
ethane;7-methoxy-1H-1,8-naphthyridin-4-one
CID 155694720
4-chloro-5-iodo-2-(6-methoxy-2-pyridinyl)-6-methylpyrimidine
CID 103347901
[5,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-yl]hydrazine
CID 62250569
5-bromo-2-(5-methylfuran-2-yl)-6-phenylpyrimidin-4-amine
CID 66302594
5-fluoro-N,6-dimethyl-2-(5-methylfuran-2-yl)pyrimidin-4-amine
CID 66000214
(6-methoxy-1H-pyrrolo[2,3-b]pyridin-4-yl)methanol
CID 74891260
5-bromo-4,6-dichloro-2-(5-methylfuran-2-yl)pyrimidine
CID 66313382

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine?
The IUPAC name of 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine (CID 155753624) is 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine.
What is the SMILES notation for 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine?
The canonical SMILES for 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine is COc1cccc(-c2nc(-c3ccc(C)o3)nc3[nH]ccc23)n1.
What is the InChIKey of 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine?
The InChIKey is VLVLKUSXQKRCRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c1-10-6-7-13(23-10)17-20-15(11-8-9-18-16(11)21-17)12-4-3-5-14(19-12)22-2/h3-9H,1-2H3,(H,18,20,21).
What are the key properties of 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine?
4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine has a molecular weight of 306.33 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxy-2-pyridinyl)-2-(5-methylfuran-2-yl)-7H-pyrrolo[2,3-d]pyrimidine is sourced from PubChem (CID 155753624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).