4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one

C15H18N4O2 — CID 167528301

IUPAC4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one
SMILESNc1nc(=O)n(C2CCCC2O)c2nc(C3CC3)ccc12
InChIInChI=1S/C15H18N4O2/c16-13-9-6-7-10(8-4-5-8)17-14(9)19(15(21)18-13)11-2-1-3-12(11)20/h6-8,11-12,20H,1-5H2,(H2,16,18,21)
InChIKeyBSYJLCVTSZMFCJ-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.34
Rot. Bonds2

About 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one

4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one (PubChem CID 167528301) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one
PubChem CID167528301
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one
SMILESNc1nc(=O)n(C2CCCC2O)c2nc(C3CC3)ccc12
InChIInChI=1S/C15H18N4O2/c16-13-9-6-7-10(8-4-5-8)17-14(9)19(15(21)18-13)11-2-1-3-12(11)20/h6-8,11-12,20H,1-5H2,(H2,16,18,21)
InChIKeyBSYJLCVTSZMFCJ-UHFFFAOYSA-N
XLogP1.34
TPSA94.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one?
The IUPAC name of 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one (CID 167528301) is 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one.
What is the SMILES notation for 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one?
The canonical SMILES for 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one is Nc1nc(=O)n(C2CCCC2O)c2nc(C3CC3)ccc12.
What is the InChIKey of 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one?
The InChIKey is BSYJLCVTSZMFCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c16-13-9-6-7-10(8-4-5-8)17-14(9)19(15(21)18-13)11-2-1-3-12(11)20/h6-8,11-12,20H,1-5H2,(H2,16,18,21).
What are the key properties of 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one?
4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one has a molecular weight of 286.33 g/mol, XLogP of 1.34, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-7-cyclopropyl-1-(2-hydroxycyclopentyl)pyrido[2,3-d]pyrimidin-2-one is sourced from PubChem (CID 167528301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).