2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine

C13H13N3O — CID 83862354

IUPAC2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
SMILESCc1ccccc1-c1nc(N)c2c(n1)COC2
InChIInChI=1S/C13H13N3O/c1-8-4-2-3-5-9(8)13-15-11-7-17-6-10(11)12(14)16-13/h2-5H,6-7H2,1H3,(H2,14,15,16)
InChIKeyBNUNXIGFSVVJNQ-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.06
Rot. Bonds1

About 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine

2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine (PubChem CID 83862354) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
PubChem CID83862354
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC Name2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
SMILESCc1ccccc1-c1nc(N)c2c(n1)COC2
InChIInChI=1S/C13H13N3O/c1-8-4-2-3-5-9(8)13-15-11-7-17-6-10(11)12(14)16-13/h2-5H,6-7H2,1H3,(H2,14,15,16)
InChIKeyBNUNXIGFSVVJNQ-UHFFFAOYSA-N
XLogP2.06
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,3-dimethylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472866
5-bromo-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306257
6-(2-methylphenyl)-1,3,5-triazine-2,4-diamine
CID 2730671
2-(2-cyclopropylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 79977157
[2-(2-methylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]hydrazine
CID 62250852
5-methyl-2-(2-methylphenyl)-6-phenylpyrimidin-4-amine
CID 104846734
5-iodo-2-(2-methylphenyl)-6-propylpyrimidin-4-amine
CID 66307571
4-amino-6-methyl-2-(2-methylphenyl)pyrimidine-5-carboxamide
CID 116648136
5-bromo-2-(2-methylphenyl)-6-propan-2-ylpyrimidin-4-amine
CID 66301281
[2-(2-methylphenyl)-5,6,7,8-tetrahydroquinazolin-4-yl]hydrazine
CID 62252758
4-chloro-2-(2-methylphenyl)-5,7-dihydrothieno[3,4-d]pyrimidine
CID 83196766
4-(2-methylphenyl)-1,3,5-triazin-2-amine
CID 63868713

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
The IUPAC name of 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine (CID 83862354) is 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
The canonical SMILES for 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine is Cc1ccccc1-c1nc(N)c2c(n1)COC2.
What is the InChIKey of 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
The InChIKey is BNUNXIGFSVVJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-8-4-2-3-5-9(8)13-15-11-7-17-6-10(11)12(14)16-13/h2-5H,6-7H2,1H3,(H2,14,15,16).
What are the key properties of 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine has a molecular weight of 227.27 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 83862354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).