2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

C8H12N4 — CID 65348931

IUPAC2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine
SMILESCNc1nc(N)c2c(n1)CCC2
InChIInChI=1S/C8H12N4/c1-10-8-11-6-4-2-3-5(6)7(9)12-8/h2-4H2,1H3,(H3,9,10,11,12)
InChIKeyBRWZNJKPFCSIBL-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.59
Rot. Bonds1

About 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine

2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine (PubChem CID 65348931) has the molecular formula C8H12N4 and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine
PubChem CID65348931
Molecular FormulaC8H12N4
Molecular Weight164.21 g/mol
Exact Mass164.11
IUPAC Name2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine
SMILESCNc1nc(N)c2c(n1)CCC2
InChIInChI=1S/C8H12N4/c1-10-8-11-6-4-2-3-5(6)7(9)12-8/h2-4H2,1H3,(H3,9,10,11,12)
InChIKeyBRWZNJKPFCSIBL-UHFFFAOYSA-N
XLogP0.59
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine?
The IUPAC name of 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine (CID 65348931) is 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine?
The canonical SMILES for 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine is CNc1nc(N)c2c(n1)CCC2.
What is the InChIKey of 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine?
The InChIKey is BRWZNJKPFCSIBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4/c1-10-8-11-6-4-2-3-5(6)7(9)12-8/h2-4H2,1H3,(H3,9,10,11,12).
What are the key properties of 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine?
2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine has a molecular weight of 164.21 g/mol, XLogP of 0.59, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidine-2,4-diamine is sourced from PubChem (CID 65348931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).