6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine

C14H15N7 — CID 125484319

IUPAC6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine
SMILESCc1ccc(-c2nc3c(N)nc(N)nc3nc2N)cc1C
InChIInChI=1S/C14H15N7/c1-6-3-4-8(5-7(6)2)9-11(15)19-13-10(18-9)12(16)20-14(17)21-13/h3-5H,1-2H3,(H6,15,16,17,19,20,21)
InChIKeyUIEADXYCWUGRIH-UHFFFAOYSA-N
MW281.32 g/mol
LogP1.45
Rot. Bonds1

About 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine

6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine (PubChem CID 125484319) has the molecular formula C14H15N7 and a molecular weight of 281.32 g/mol. Its IUPAC name is 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine.

Molecular Properties

Compound Name6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine
PubChem CID125484319
Molecular FormulaC14H15N7
Molecular Weight281.32 g/mol
Exact Mass281.14
IUPAC Name6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine
SMILESCc1ccc(-c2nc3c(N)nc(N)nc3nc2N)cc1C
InChIInChI=1S/C14H15N7/c1-6-3-4-8(5-7(6)2)9-11(15)19-13-10(18-9)12(16)20-14(17)21-13/h3-5H,1-2H3,(H6,15,16,17,19,20,21)
InChIKeyUIEADXYCWUGRIH-UHFFFAOYSA-N
XLogP1.45
TPSA129.62 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 51.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

6-(3-bromophenyl)pteridine-2,4,7-triamine
CID 118987043
3-[2,4-diamino-7-(3-hydroxyphenyl)pteridin-6-yl]phenol;dihydrochloride
CID 18455700
2-(2,4,7-triaminopteridin-6-yl)phenol
CID 135735591
4-Hydroxy triamterene sulfate potassium salt
CID 169442251
4-(2,4-diaminopteridin-7-yl)-2-methylphenol
CID 142881366
6-chloro-4-(3,4-dimethylphenyl)pyrido[3,2-d]pyrimidin-2-amine
CID 87622003
6-[4-[2-(diethylamino)ethoxy]phenyl]pteridine-2,4,7-triamine
CID 3025515
4-(3,4-dimethylphenyl)-6-methylpyrimidin-2-amine
CID 62481951
2-tert-butyl-6-(3,4-dimethylphenyl)-5-methylpyrimidin-4-amine
CID 80975520
6-(3,4-dimethylphenyl)-5-phenyl-1,2,4-triazin-3-amine
CID 53353233
6-(3,4-dimethylphenyl)-1,2,4-triazin-5-amine
CID 116822961
6-(4-methoxyphenyl)-7-(1-methylimidazol-2-yl)pteridine-2,4-diamine
CID 171986786

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine?
The IUPAC name of 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine (CID 125484319) is 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine.
What is the SMILES notation for 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine?
The canonical SMILES for 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine is Cc1ccc(-c2nc3c(N)nc(N)nc3nc2N)cc1C.
What is the InChIKey of 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine?
The InChIKey is UIEADXYCWUGRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N7/c1-6-3-4-8(5-7(6)2)9-11(15)19-13-10(18-9)12(16)20-14(17)21-13/h3-5H,1-2H3,(H6,15,16,17,19,20,21).
What are the key properties of 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine?
6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine has a molecular weight of 281.32 g/mol, XLogP of 1.45, 1 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethylphenyl)pteridine-2,4,7-triamine is sourced from PubChem (CID 125484319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).