1H-cyclopenta[d]pyrimidin-5-ol

C7H6N2O — CID 123562253

IUPAC1H-cyclopenta[d]pyrimidin-5-ol
SMILESOc1ccc2[nH]cncc1-2
InChIInChI=1S/C7H6N2O/c10-7-2-1-6-5(7)3-8-4-9-6/h1-4,10H,(H,8,9)
InChIKeyNXRCMDLCCQUQLX-UHFFFAOYSA-N
MW134.14 g/mol
LogP1.22
Rot. Bonds

About 1H-cyclopenta[d]pyrimidin-5-ol

1H-cyclopenta[d]pyrimidin-5-ol (PubChem CID 123562253) has the molecular formula C7H6N2O and a molecular weight of 134.14 g/mol. Its IUPAC name is 1H-cyclopenta[d]pyrimidin-5-ol.

Molecular Properties

Compound Name1H-cyclopenta[d]pyrimidin-5-ol
PubChem CID123562253
Molecular FormulaC7H6N2O
Molecular Weight134.14 g/mol
Exact Mass134.05
IUPAC Name1H-cyclopenta[d]pyrimidin-5-ol
SMILESOc1ccc2[nH]cncc1-2
InChIInChI=1S/C7H6N2O/c10-7-2-1-6-5(7)3-8-4-9-6/h1-4,10H,(H,8,9)
InChIKeyNXRCMDLCCQUQLX-UHFFFAOYSA-N
XLogP1.22
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1H-cyclopenta[d]pyrimidin-5-ol?
The IUPAC name of 1H-cyclopenta[d]pyrimidin-5-ol (CID 123562253) is 1H-cyclopenta[d]pyrimidin-5-ol.
What is the SMILES notation for 1H-cyclopenta[d]pyrimidin-5-ol?
The canonical SMILES for 1H-cyclopenta[d]pyrimidin-5-ol is Oc1ccc2[nH]cncc1-2.
What is the InChIKey of 1H-cyclopenta[d]pyrimidin-5-ol?
The InChIKey is NXRCMDLCCQUQLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O/c10-7-2-1-6-5(7)3-8-4-9-6/h1-4,10H,(H,8,9).
What are the key properties of 1H-cyclopenta[d]pyrimidin-5-ol?
1H-cyclopenta[d]pyrimidin-5-ol has a molecular weight of 134.14 g/mol, XLogP of 1.22, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-cyclopenta[d]pyrimidin-5-ol is sourced from PubChem (CID 123562253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).