(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol

C13H21N3O — CID 66696107

IUPAC(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol
SMILESCCc1cnc(N2CCC([C@@H](C)O)CC2)nc1
InChIInChI=1S/C13H21N3O/c1-3-11-8-14-13(15-9-11)16-6-4-12(5-7-16)10(2)17/h8-10,12,17H,3-7H2,1-2H3/t10-/m1/s1
InChIKeyUZSOECPQHGTCHK-SNVBAGLBSA-N
MW235.33 g/mol
LogP1.64
Rot. Bonds3

About (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol

(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol (PubChem CID 66696107) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol
PubChem CID66696107
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol
SMILESCCc1cnc(N2CCC([C@@H](C)O)CC2)nc1
InChIInChI=1S/C13H21N3O/c1-3-11-8-14-13(15-9-11)16-6-4-12(5-7-16)10(2)17/h8-10,12,17H,3-7H2,1-2H3/t10-/m1/s1
InChIKeyUZSOECPQHGTCHK-SNVBAGLBSA-N
XLogP1.64
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-2-(4-propan-2-ylpiperidin-1-yl)pyrimidine;propane
CID 145380179
5-ethyl-2-[4-[(1S)-1-methoxyethyl]piperidin-1-yl]pyrimidine
CID 131998372
1-[1-(5-fluoropyrimidin-2-yl)piperidin-4-yl]ethanol
CID 103826127
2-[4-(3,3-dimethylbutan-2-yl)piperidin-1-yl]-5-ethylpyrimidine
CID 131998942
1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanone
CID 58567804
1-[1-(5-methylpyrimidin-2-yl)pyrrolidin-3-yl]ethanol
CID 112627788
1-[1-(5-chloropyrimidin-2-yl)pyrrolidin-3-yl]ethanol
CID 112627785
1-[1-(5-fluoropyrimidin-2-yl)pyrrolidin-3-yl]ethanol
CID 103990084
N-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-N-methylacetamide
CID 154582448
[1-[5-(2-methylpropyl)pyrimidin-2-yl]piperidin-4-yl]methanol
CID 116976091
1-(5-ethylpyrimidin-2-yl)-4-(hydroxymethyl)piperidin-4-ol
CID 56755831
5-(2-methylpropyl)-2-[4-(2-methylpropyl)piperidin-1-yl]pyrimidine
CID 59474375

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol?
The IUPAC name of (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol (CID 66696107) is (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol.
What is the SMILES notation for (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol?
The canonical SMILES for (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol is CCc1cnc(N2CCC([C@@H](C)O)CC2)nc1.
What is the InChIKey of (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol?
The InChIKey is UZSOECPQHGTCHK-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-11-8-14-13(15-9-11)16-6-4-12(5-7-16)10(2)17/h8-10,12,17H,3-7H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol?
(1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol has a molecular weight of 235.33 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]ethanol is sourced from PubChem (CID 66696107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).