2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one

C10H14N2O2 — CID 104609905

IUPAC2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
SMILESCOC1(c2nccc(=O)[nH]2)CCCC1
InChIInChI=1S/C10H14N2O2/c1-14-10(5-2-3-6-10)9-11-7-4-8(13)12-9/h4,7H,2-3,5-6H2,1H3,(H,11,12,13)
InChIKeyYRVQTRCXFZVSCV-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.19
Rot. Bonds2

About 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one

2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one (PubChem CID 104609905) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
PubChem CID104609905
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
SMILESCOC1(c2nccc(=O)[nH]2)CCCC1
InChIInChI=1S/C10H14N2O2/c1-14-10(5-2-3-6-10)9-11-7-4-8(13)12-9/h4,7H,2-3,5-6H2,1H3,(H,11,12,13)
InChIKeyYRVQTRCXFZVSCV-UHFFFAOYSA-N
XLogP1.19
TPSA54.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxypropan-2-yl)-1H-pyrimidin-6-one
CID 79202604
2-(2-methyloxolan-2-yl)-1H-pyrimidin-6-one
CID 80167116
2-(2-methyloxan-2-yl)-1H-pyrimidin-6-one
CID 80690677
4-hydroxy-2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
CID 104609913
5-bromo-2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
CID 104609933
5-iodo-2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
CID 104609934
2-(1-methoxycyclopentyl)-6-oxo-1H-pyrimidine-5-carbonitrile
CID 104612125
5-(aminomethyl)-2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one
CID 104612126
2-(1-ethoxycyclopentyl)-6-oxo-1H-pyrimidine-5-carbonitrile
CID 113563472
2-(1-methoxycyclopentyl)-5-(methylaminomethyl)-1H-pyrimidin-6-one
CID 114206201
2-(1-methoxycyclobutyl)-1H-pyrimidin-6-one
CID 116705562
2-(1-methoxycycloheptyl)-1H-pyrimidin-6-one
CID 116744915

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one?
The IUPAC name of 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one (CID 104609905) is 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one is COC1(c2nccc(=O)[nH]2)CCCC1.
What is the InChIKey of 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one?
The InChIKey is YRVQTRCXFZVSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-14-10(5-2-3-6-10)9-11-7-4-8(13)12-9/h4,7H,2-3,5-6H2,1H3,(H,11,12,13).
What are the key properties of 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one?
2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one has a molecular weight of 194.23 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclopentyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 104609905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).