N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine

C14H13N3O2 — CID 57428969

IUPACN-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(Nc2ncnc3occ(C)c23)cc1
InChIInChI=1S/C14H13N3O2/c1-9-7-19-14-12(9)13(15-8-16-14)17-10-3-5-11(18-2)6-4-10/h3-8H,1-2H3,(H,15,16,17)
InChIKeyCJKIPQGVCWHDDT-UHFFFAOYSA-N
MW255.28 g/mol
LogP3.28
Rot. Bonds3

About N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine

N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine (PubChem CID 57428969) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine
PubChem CID57428969
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC NameN-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(Nc2ncnc3occ(C)c23)cc1
InChIInChI=1S/C14H13N3O2/c1-9-7-19-14-12(9)13(15-8-16-14)17-10-3-5-11(18-2)6-4-10/h3-8H,1-2H3,(H,15,16,17)
InChIKeyCJKIPQGVCWHDDT-UHFFFAOYSA-N
XLogP3.28
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

tris(4-chloro-5-methylfuro[2,3-d]pyrimidine);methane;4-methoxyaniline;4-methoxy-N-methylaniline;N-(4-methoxyphenyl)-N,5-dimethylfuro[2,3-d]pyrimidin-4-amine;bis(N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine);4-(methylamino)phenol;4-[methyl-(5-methylfuro[2,3-d]pyrimidin-4-yl)amino]phenol;trihydrochloride
CID 157324399
4-N-(4-methoxyphenyl)-6-(2-phenylhydrazinyl)pyrimidine-4,5-diamine
CID 19144334
4-N-(4-methoxyphenyl)pyrimidine-4,5,6-triamine
CID 19137145
3-(4-methoxyphenyl)-N-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 19082673
N-(4-methoxyphenyl)-[1,3]dioxolo[4,5-g]quinazolin-8-amine
CID 66554700
5-ethyl-4-N-(4-methoxyphenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80760040
N-(4-methoxyphenyl)-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-amine;hydrochloride
CID 18593654
4-N-(5-chloro-2-methylphenyl)-6-N-(4-methoxyphenyl)pyrimidine-4,5,6-triamine
CID 22547262
4-N-(3,5-dimethylphenyl)-6-N-(4-methoxyphenyl)pyrimidine-4,6-diamine
CID 112865267
5-iodo-N-(4-methoxyphenyl)pyrimidin-4-amine
CID 66341469
6-N-(4-methoxyphenyl)-4-N-[4-(trifluoromethoxy)phenyl]pyrimidine-4,5,6-triamine
CID 19149157
(7S)-N-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-amine
CID 727499

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine (CID 57428969) is N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine is COc1ccc(Nc2ncnc3occ(C)c23)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine?
The InChIKey is CJKIPQGVCWHDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c1-9-7-19-14-12(9)13(15-8-16-14)17-10-3-5-11(18-2)6-4-10/h3-8H,1-2H3,(H,15,16,17).
What are the key properties of N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine?
N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine has a molecular weight of 255.28 g/mol, XLogP of 3.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-5-methylfuro[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 57428969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).