[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol

C13H14N2O2 — CID 62757708

IUPAC[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol
SMILESCOc1ccccc1Cc1ncc(CO)cn1
InChIInChI=1S/C13H14N2O2/c1-17-12-5-3-2-4-11(12)6-13-14-7-10(9-16)8-15-13/h2-5,7-8,16H,6,9H2,1H3
InChIKeyHRPKBMODABDHRP-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.57
Rot. Bonds4

About [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol

[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol (PubChem CID 62757708) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol
PubChem CID62757708
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol
SMILESCOc1ccccc1Cc1ncc(CO)cn1
InChIInChI=1S/C13H14N2O2/c1-17-12-5-3-2-4-11(12)6-13-14-7-10(9-16)8-15-13/h2-5,7-8,16H,6,9H2,1H3
InChIKeyHRPKBMODABDHRP-UHFFFAOYSA-N
XLogP1.57
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(chloromethyl)-2-[(2-methoxyphenyl)methyl]pyrimidine
CID 55114023
[4-[(2-methoxyphenyl)methyl]phenyl]methanol
CID 54205335
[2-[(2-methoxyphenyl)methyl]-4,6-dimethylpyrimidin-5-yl]methanol
CID 115070027
(2-(111C)methoxyphenyl)methanol
CID 59897789
[4-[(2-methoxyphenyl)methoxy]phenyl]methanol
CID 54940415
[5-[(2-methoxyphenyl)methyl]-1,2-oxazol-4-yl]methanol
CID 115093727
(1S)-1-[2-[(2-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanamine
CID 103432032
[5-chloro-6-[(2-methoxyphenyl)methyl-methylamino]-3-pyridinyl]methanol
CID 61417850
[6-(2,6-dimethoxyphenyl)-3-pyridinyl]methanol
CID 24729907
2-[2-[(2-methoxyphenyl)methyl]-1,3-oxazol-5-yl]propan-1-ol
CID 115086826
N-ethyl-2-[(2-methoxyphenyl)methyl]pyrimidin-4-amine
CID 55045486
N-ethyl-1-[2-[(2-methoxyphenyl)methyl]-4-methylpyrimidin-5-yl]ethanamine
CID 62771730

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol?
The IUPAC name of [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol (CID 62757708) is [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol.
What is the SMILES notation for [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol?
The canonical SMILES for [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol is COc1ccccc1Cc1ncc(CO)cn1.
What is the InChIKey of [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol?
The InChIKey is HRPKBMODABDHRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-17-12-5-3-2-4-11(12)6-13-14-7-10(9-16)8-15-13/h2-5,7-8,16H,6,9H2,1H3.
What are the key properties of [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol?
[2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol has a molecular weight of 230.27 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methoxyphenyl)methyl]pyrimidin-5-yl]methanol is sourced from PubChem (CID 62757708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).