2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C15H24N4O — CID 16876755

IUPAC2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCc1nc2c(c(NCCCN3CCOCC3)n1)CCC2
InChIInChI=1S/C15H24N4O/c1-12-17-14-5-2-4-13(14)15(18-12)16-6-3-7-19-8-10-20-11-9-19/h2-11H2,1H3,(H,16,17,18)
InChIKeyDNRFTDKXQMHZKI-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.41
Rot. Bonds5

About 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 16876755) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID16876755
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESCc1nc2c(c(NCCCN3CCOCC3)n1)CCC2
InChIInChI=1S/C15H24N4O/c1-12-17-14-5-2-4-13(14)15(18-12)16-6-3-7-19-8-10-20-11-9-19/h2-11H2,1H3,(H,16,17,18)
InChIKeyDNRFTDKXQMHZKI-UHFFFAOYSA-N
XLogP1.41
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 16876755) is 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is Cc1nc2c(c(NCCCN3CCOCC3)n1)CCC2.
What is the InChIKey of 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is DNRFTDKXQMHZKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-12-17-14-5-2-4-13(14)15(18-12)16-6-3-7-19-8-10-20-11-9-19/h2-11H2,1H3,(H,16,17,18).
What are the key properties of 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 276.38 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-morpholin-4-ylpropyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 16876755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).