7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine

C7H10N4 — CID 166825056

IUPAC7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine
SMILESCC1=CNC2C(N)=NC=NC12
InChIInChI=1S/C7H10N4/c1-4-2-9-6-5(4)10-3-11-7(6)8/h2-3,5-6,9H,1H3,(H2,8,10,11)
InChIKeyGSMGIAVAIYUWOF-UHFFFAOYSA-N
MW150.18 g/mol
LogP-0.37
Rot. Bonds

About 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine

7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine (PubChem CID 166825056) has the molecular formula C7H10N4 and a molecular weight of 150.18 g/mol. Its IUPAC name is 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine
PubChem CID166825056
Molecular FormulaC7H10N4
Molecular Weight150.18 g/mol
Exact Mass150.09
IUPAC Name7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine
SMILESCC1=CNC2C(N)=NC=NC12
InChIInChI=1S/C7H10N4/c1-4-2-9-6-5(4)10-3-11-7(6)8/h2-3,5-6,9H,1H3,(H2,8,10,11)
InChIKeyGSMGIAVAIYUWOF-UHFFFAOYSA-N
XLogP-0.37
TPSA62.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine (CID 166825056) is 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine is CC1=CNC2C(N)=NC=NC12.
What is the InChIKey of 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine?
The InChIKey is GSMGIAVAIYUWOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4/c1-4-2-9-6-5(4)10-3-11-7(6)8/h2-3,5-6,9H,1H3,(H2,8,10,11).
What are the key properties of 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine?
7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine has a molecular weight of 150.18 g/mol, XLogP of -0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-5,7a-dihydro-4aH-pyrrolo[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 166825056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).