2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one

C17H14N2O2 — CID 103241188

IUPAC2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one
SMILESO=c1cc(Oc2cccc3ccccc23)nc(C2CC2)[nH]1
InChIInChI=1S/C17H14N2O2/c20-15-10-16(19-17(18-15)12-8-9-12)21-14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10,12H,8-9H2,(H,18,19,20)
InChIKeyAFWLMNHGZRGGEI-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.59
Rot. Bonds3

About 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one

2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one (PubChem CID 103241188) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one
PubChem CID103241188
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one
SMILESO=c1cc(Oc2cccc3ccccc23)nc(C2CC2)[nH]1
InChIInChI=1S/C17H14N2O2/c20-15-10-16(19-17(18-15)12-8-9-12)21-14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10,12H,8-9H2,(H,18,19,20)
InChIKeyAFWLMNHGZRGGEI-UHFFFAOYSA-N
XLogP3.59
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-4-(2,3-dimethylphenoxy)-1H-pyrimidin-6-one
CID 103241006
2-methyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one
CID 103241191
N-[2-[(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)oxy]phenyl]acetamide
CID 103241223
2-ethyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one
CID 103241192
2-cyclopropyl-4-(5-fluoro-2-methylphenoxy)-1H-pyrimidin-6-one
CID 103242112
2-cyclopropyl-4-(3-methylphenoxy)-1H-pyrimidin-6-one
CID 103241116
2-cyclopropyl-4-(2,4-dimethylphenoxy)-1H-pyrimidin-6-one
CID 103240966
4-[2-(aminomethyl)-4-bromophenoxy]-2-cyclopropyl-1H-pyrimidin-6-one
CID 114585999
2-cyclopropyl-4-[4-(trifluoromethyl)phenoxy]-1H-pyrimidin-6-one
CID 103240890
5-amino-2-[(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)oxy]benzonitrile
CID 114578692
4-(1,3-benzodioxol-5-yloxy)-2-cyclopropyl-1H-pyrimidin-6-one
CID 103241257
2-cyclopropyl-4-(2-ethoxyphenyl)-1H-pyrimidin-6-one
CID 136692612

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one?
The IUPAC name of 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one (CID 103241188) is 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one is O=c1cc(Oc2cccc3ccccc23)nc(C2CC2)[nH]1.
What is the InChIKey of 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one?
The InChIKey is AFWLMNHGZRGGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c20-15-10-16(19-17(18-15)12-8-9-12)21-14-7-3-5-11-4-1-2-6-13(11)14/h1-7,10,12H,8-9H2,(H,18,19,20).
What are the key properties of 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one?
2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one has a molecular weight of 278.31 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-naphthalen-1-yloxy-1H-pyrimidin-6-one is sourced from PubChem (CID 103241188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).