7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine

C8H10FN3 — CID 143833654

IUPAC7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine
SMILESCc1ncnc2c1NCC2(C)F
InChIInChI=1S/C8H10FN3/c1-5-6-7(12-4-11-5)8(2,9)3-10-6/h4,10H,3H2,1-2H3
InChIKeySTERBHDYELPDPP-UHFFFAOYSA-N
MW167.19 g/mol
LogP1.40
Rot. Bonds

About 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine

7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine (PubChem CID 143833654) has the molecular formula C8H10FN3 and a molecular weight of 167.19 g/mol. Its IUPAC name is 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine.

Molecular Properties

Compound Name7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine
PubChem CID143833654
Molecular FormulaC8H10FN3
Molecular Weight167.19 g/mol
Exact Mass167.09
IUPAC Name7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine
SMILESCc1ncnc2c1NCC2(C)F
InChIInChI=1S/C8H10FN3/c1-5-6-7(12-4-11-5)8(2,9)3-10-6/h4,10H,3H2,1-2H3
InChIKeySTERBHDYELPDPP-UHFFFAOYSA-N
XLogP1.40
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.19
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,7-dihydro-5H-pyrrolo[3,2-d]pyrimidine
CID 21961500
4-(2,2,2-trifluoroethyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine-2-carbonitrile
CID 123916444
4-(5-Fluoro-4-methylhex-5-enyl)-6-methylpyrimidin-5-amine
CID 126593499
4-fluoro-2,7-dimethyl-6,7-dihydro-5H-pyrrolo[3,2-d]pyrimidine
CID 143015264
(Z)-1-[7-methyl-7-(trifluoromethyl)-5,6-dihydropyrrolo[3,2-d]pyrimidin-2-yl]but-1-en-2-amine
CID 156803084
4-(3,3-Difluoropentyl)-6-propan-2-ylpyrimidin-5-amine
CID 170041928
4-ethyl-4-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
CID 50954289
N-(2,2,2-trifluoroethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62832046
4-(trifluoromethyl)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidine
CID 83847104
N'-(5-fluoro-6-propan-2-ylpyrimidin-4-yl)ethane-1,2-diamine
CID 84039947
6-ethyl-5-fluoro-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 92131015
N-[[1-(dimethylamino)cyclopentyl]methyl]-6-ethyl-5-fluoropyrimidin-4-amine
CID 103879834

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine?
The IUPAC name of 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine (CID 143833654) is 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine.
What is the SMILES notation for 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine?
The canonical SMILES for 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine is Cc1ncnc2c1NCC2(C)F.
What is the InChIKey of 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine?
The InChIKey is STERBHDYELPDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FN3/c1-5-6-7(12-4-11-5)8(2,9)3-10-6/h4,10H,3H2,1-2H3.
What are the key properties of 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine?
7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine has a molecular weight of 167.19 g/mol, XLogP of 1.40, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4,7-dimethyl-5,6-dihydropyrrolo[3,2-d]pyrimidine is sourced from PubChem (CID 143833654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).