4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine

C9H15N5 — CID 83862337

IUPAC4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine
SMILESCN1Cc2nc(N)nc(CCN)c2C1
InChIInChI=1S/C9H15N5/c1-14-4-6-7(2-3-10)12-9(11)13-8(6)5-14/h2-5,10H2,1H3,(H2,11,12,13)
InChIKeyRNRZZVLOPOCAQK-UHFFFAOYSA-N
MW193.25 g/mol
LogP-0.49
Rot. Bonds2

About 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine

4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine (PubChem CID 83862337) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine
PubChem CID83862337
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine
SMILESCN1Cc2nc(N)nc(CCN)c2C1
InChIInChI=1S/C9H15N5/c1-14-4-6-7(2-3-10)12-9(11)13-8(6)5-14/h2-5,10H2,1H3,(H2,11,12,13)
InChIKeyRNRZZVLOPOCAQK-UHFFFAOYSA-N
XLogP-0.49
TPSA81.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine?
The IUPAC name of 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine (CID 83862337) is 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine.
What is the SMILES notation for 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine?
The canonical SMILES for 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine is CN1Cc2nc(N)nc(CCN)c2C1.
What is the InChIKey of 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine?
The InChIKey is RNRZZVLOPOCAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c1-14-4-6-7(2-3-10)12-9(11)13-8(6)5-14/h2-5,10H2,1H3,(H2,11,12,13).
What are the key properties of 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine?
4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine has a molecular weight of 193.25 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-6-methyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-amine is sourced from PubChem (CID 83862337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).