2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

C15H21N3O — CID 53192889

IUPAC2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESC1Cc2nc(C3CC3)nc(NCC3CCCO3)c2C1
InChIInChI=1S/C15H21N3O/c1-4-12-13(5-1)17-14(10-6-7-10)18-15(12)16-9-11-3-2-8-19-11/h10-11H,1-9H2,(H,16,17,18)
InChIKeyAMONZDBQMRFQPP-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.43
Rot. Bonds4

About 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (PubChem CID 53192889) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
PubChem CID53192889
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
SMILESC1Cc2nc(C3CC3)nc(NCC3CCCO3)c2C1
InChIInChI=1S/C15H21N3O/c1-4-12-13(5-1)17-14(10-6-7-10)18-15(12)16-9-11-3-2-8-19-11/h10-11H,1-9H2,(H,16,17,18)
InChIKeyAMONZDBQMRFQPP-UHFFFAOYSA-N
XLogP2.43
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine (CID 53192889) is 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is C1Cc2nc(C3CC3)nc(NCC3CCCO3)c2C1.
What is the InChIKey of 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
The InChIKey is AMONZDBQMRFQPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-4-12-13(5-1)17-14(10-6-7-10)18-15(12)16-9-11-3-2-8-19-11/h10-11H,1-9H2,(H,16,17,18).
What are the key properties of 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine?
2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine has a molecular weight of 259.35 g/mol, XLogP of 2.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(oxolan-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine is sourced from PubChem (CID 53192889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).