4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine

C17H15N3O2 — CID 118729849

IUPAC4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine
SMILESCOc1ccc2c(ccn2-c2nc(C)nc3oc(C)cc23)c1
InChIInChI=1S/C17H15N3O2/c1-10-8-14-16(18-11(2)19-17(14)22-10)20-7-6-12-9-13(21-3)4-5-15(12)20/h4-9H,1-3H3
InChIKeyUDKMOAHOTPOVJU-UHFFFAOYSA-N
MW293.33 g/mol
LogP3.79
Rot. Bonds2

About 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine

4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine (PubChem CID 118729849) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine.

Molecular Properties

Compound Name4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine
PubChem CID118729849
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC Name4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine
SMILESCOc1ccc2c(ccn2-c2nc(C)nc3oc(C)cc23)c1
InChIInChI=1S/C17H15N3O2/c1-10-8-14-16(18-11(2)19-17(14)22-10)20-7-6-12-9-13(21-3)4-5-15(12)20/h4-9H,1-3H3
InChIKeyUDKMOAHOTPOVJU-UHFFFAOYSA-N
XLogP3.79
TPSA53.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxyphenyl)-N,2,6-trimethylfuro(2,3-d)pyrimidin-4-amine
CID 44611919
5-[(1E)-(methoxyimino)methyl]-6-[(1-methyl-1H-indol-5-yl)oxy]pyrimidin-4-amine
CID 23646048
4-Methoxy-3-[4-(2-methyl-imidazo[4,5-c]pyridin-1-ylmethyl)-benzoyl]-indole-1-carboxylic acid dimethylamide
CID 10790411
5-(6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-yloxy)-N-[5-(1-methylcyclopropyl)-1,2-oxazol-3-yl]indole-1-carboxamide
CID 46224334
5-[[(6S)-7-acetyl-6-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]oxy]-N-(5-cyclopropyl-1,2-oxazol-3-yl)indole-1-carboxamide
CID 56970263
N-(5-tert-butyl-1,2-oxazol-3-yl)-5-(5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-yloxy)indole-1-carboxamide
CID 59394005
5-[(6-acetyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-4-yl)oxy]-N-(5-cyclopropyl-1,2-oxazol-3-yl)indole-1-carboxamide
CID 59394015
5-[6-(methylaminomethyl)pyrimidin-4-yl]oxy-N-[5-[1-(trifluoromethyl)cyclopropyl]-1,2-oxazol-3-yl]indole-1-carboxamide
CID 59394146
N-(5-cyclopropyl-1,2-oxazol-3-yl)-5-[6-(methylaminomethyl)pyrimidin-4-yl]oxyindole-1-carboxamide
CID 59394177
N-(5-cyclopropyl-1,2-oxazol-3-yl)-5-(6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-4-yloxy)indole-1-carboxamide
CID 59394193
5-[6-(methylaminomethyl)pyrimidin-4-yl]oxy-N-[5-(1-methylcyclopropyl)-1,2-oxazol-3-yl]indole-1-carboxamide
CID 59394220
N-(5-cyclopropyl-1,2-oxazol-3-yl)-5-[(7-ethyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl)oxy]indole-1-carboxamide
CID 59394228

Frequently Asked Questions

What is the IUPAC name of 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine?
The IUPAC name of 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine (CID 118729849) is 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine.
What is the SMILES notation for 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine?
The canonical SMILES for 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine is COc1ccc2c(ccn2-c2nc(C)nc3oc(C)cc23)c1.
What is the InChIKey of 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine?
The InChIKey is UDKMOAHOTPOVJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-10-8-14-16(18-11(2)19-17(14)22-10)20-7-6-12-9-13(21-3)4-5-15(12)20/h4-9H,1-3H3.
What are the key properties of 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine?
4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine has a molecular weight of 293.33 g/mol, XLogP of 3.79, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methoxyindol-1-yl)-2,6-dimethylfuro[2,3-d]pyrimidine is sourced from PubChem (CID 118729849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).