1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine

C9H10N4 — CID 67260942

IUPAC1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine
SMILESc1cc2cnc3c(n2c1)NCNC3
InChIInChI=1S/C9H10N4/c1-2-7-4-11-8-5-10-6-12-9(8)13(7)3-1/h1-4,10,12H,5-6H2
InChIKeyQNDJABDNZYQITQ-UHFFFAOYSA-N
MW174.21 g/mol
LogP0.81
Rot. Bonds

About 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine

1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine (PubChem CID 67260942) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine.

Molecular Properties

Compound Name1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine
PubChem CID67260942
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine
SMILESc1cc2cnc3c(n2c1)NCNC3
InChIInChI=1S/C9H10N4/c1-2-7-4-11-8-5-10-6-12-9(8)13(7)3-1/h1-4,10,12H,5-6H2
InChIKeyQNDJABDNZYQITQ-UHFFFAOYSA-N
XLogP0.81
TPSA41.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine?
The IUPAC name of 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine (CID 67260942) is 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine.
What is the SMILES notation for 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine?
The canonical SMILES for 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine is c1cc2cnc3c(n2c1)NCNC3.
What is the InChIKey of 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine?
The InChIKey is QNDJABDNZYQITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-2-7-4-11-8-5-10-6-12-9(8)13(7)3-1/h1-4,10,12H,5-6H2.
What are the key properties of 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine?
1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine has a molecular weight of 174.21 g/mol, XLogP of 0.81, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetrahydropyrrolo[2,1-h]pteridine is sourced from PubChem (CID 67260942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).