2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol

C10H15N3O — CID 77059115

IUPAC2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol
SMILESOCCC1CCN(c2ncccn2)C1
InChIInChI=1S/C10H15N3O/c14-7-3-9-2-6-13(8-9)10-11-4-1-5-12-10/h1,4-5,9,14H,2-3,6-8H2
InChIKeyOHFJJXBKEXJBRK-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.69
Rot. Bonds3

About 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol

2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol (PubChem CID 77059115) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol
PubChem CID77059115
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol
SMILESOCCC1CCN(c2ncccn2)C1
InChIInChI=1S/C10H15N3O/c14-7-3-9-2-6-13(8-9)10-11-4-1-5-12-10/h1,4-5,9,14H,2-3,6-8H2
InChIKeyOHFJJXBKEXJBRK-UHFFFAOYSA-N
XLogP0.69
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(4-methylpyrimidin-2-yl)pyrrolidin-3-yl]ethanol
CID 115657972
2-[1-[5-[(cyclopropylamino)methyl]pyrimidin-2-yl]pyrrolidin-3-yl]ethanol
CID 114798539
2-[3-(2-bromoethyl)piperidin-1-yl]pyrimidine
CID 80679402
2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]pyridine-3-carboxamide
CID 113243984
2-[1-(4-aminopyrimidin-2-yl)piperidin-3-yl]ethanol
CID 107229189
(3R)-1-pyrimidin-2-ylpyrrolidin-3-amine
CID 71643779
2-[1-(3-propan-2-yloxy-2-pyridinyl)pyrrolidin-3-yl]ethanol
CID 114799454
1-cyclopropyl-3-[3-(2-hydroxyethyl)pyrrolidin-1-yl]pyrazin-2-one
CID 115917389
1-pyrimidin-2-ylpyrrolidin-3-amine;hydrochloride
CID 71644293
3-(1-pyrimidin-2-ylpiperidin-4-yl)propanoic acid
CID 62216311
2-[1-(5-amino-1H-1,2,4-triazol-3-yl)pyrrolidin-3-yl]ethanol
CID 114802720
2-[1-(5-chloropyrazin-2-yl)pyrrolidin-3-yl]ethanol
CID 130986944

Frequently Asked Questions

What is the IUPAC name of 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol?
The IUPAC name of 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol (CID 77059115) is 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol.
What is the SMILES notation for 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol?
The canonical SMILES for 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol is OCCC1CCN(c2ncccn2)C1.
What is the InChIKey of 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol?
The InChIKey is OHFJJXBKEXJBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-7-3-9-2-6-13(8-9)10-11-4-1-5-12-10/h1,4-5,9,14H,2-3,6-8H2.
What are the key properties of 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol?
2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol has a molecular weight of 193.25 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-pyrimidin-2-ylpyrrolidin-3-yl)ethanol is sourced from PubChem (CID 77059115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).