3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol

C14H15N3O3 — CID 143628947

IUPAC3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol
SMILESCOc1cc(O)cc(Nc2nc(C)nc3c2COC3)c1
InChIInChI=1S/C14H15N3O3/c1-8-15-13-7-20-6-12(13)14(16-8)17-9-3-10(18)5-11(4-9)19-2/h3-5,18H,6-7H2,1-2H3,(H,15,16,17)
InChIKeyBEYKOHNRHBLYAT-UHFFFAOYSA-N
MW273.29 g/mol
LogP2.27
Rot. Bonds3

About 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol

3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol (PubChem CID 143628947) has the molecular formula C14H15N3O3 and a molecular weight of 273.29 g/mol. Its IUPAC name is 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol.

Molecular Properties

Compound Name3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol
PubChem CID143628947
Molecular FormulaC14H15N3O3
Molecular Weight273.29 g/mol
Exact Mass273.11
IUPAC Name3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol
SMILESCOc1cc(O)cc(Nc2nc(C)nc3c2COC3)c1
InChIInChI=1S/C14H15N3O3/c1-8-15-13-7-20-6-12(13)14(16-8)17-9-3-10(18)5-11(4-9)19-2/h3-5,18H,6-7H2,1-2H3,(H,15,16,17)
InChIKeyBEYKOHNRHBLYAT-UHFFFAOYSA-N
XLogP2.27
TPSA76.50 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,5-dimethoxyphenyl)-2-methylsulfanyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
CID 24737637
N-(3,5-dimethoxyphenyl)-3,6-dimethyl-[1,2]oxazolo[5,4-d]pyrimidin-4-amine
CID 52998656
3-(ethylamino)-5-methoxyphenol
CID 142928379
N-(3,5-dimethoxyphenyl)-4-methyl-1,2,5-oxadiazol-3-amine
CID 157019147
3-methoxy-5-[(3S)-oxolan-3-yl]oxyphenol
CID 170566550
3-methoxy-5-[(7-piperidin-4-yloxyquinazolin-2-yl)amino]phenol
CID 70920913
4-(3-bromo-5-methoxyanilino)-6-chloro-2-methylpyrimidine-5-carbaldehyde
CID 82860476
4-amino-6-(3-methoxy-5-phenylmethoxyanilino)-2-methylpyrimidine-5-carbothioamide
CID 155680531
3-[(3,5-dimethylphenoxy)methyl]-5-methoxyphenol
CID 70951574
6-chloro-N-(3-methoxyphenyl)-2,5-dimethylpyrimidin-4-amine
CID 55229292
2,4-dimethyl-5,7-dihydrofuro[3,4-b]pyridine
CID 135256255
N-(3,5-dimethoxyphenyl)-3-methyl-1,2,4-thiadiazol-5-amine
CID 157013293

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol?
The IUPAC name of 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol (CID 143628947) is 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol.
What is the SMILES notation for 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol?
The canonical SMILES for 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol is COc1cc(O)cc(Nc2nc(C)nc3c2COC3)c1.
What is the InChIKey of 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol?
The InChIKey is BEYKOHNRHBLYAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3/c1-8-15-13-7-20-6-12(13)14(16-8)17-9-3-10(18)5-11(4-9)19-2/h3-5,18H,6-7H2,1-2H3,(H,15,16,17).
What are the key properties of 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol?
3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol has a molecular weight of 273.29 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-5-[(2-methyl-5,7-dihydrofuro[3,4-d]pyrimidin-4-yl)amino]phenol is sourced from PubChem (CID 143628947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).