1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol

C10H16N4O — CID 21279253

IUPAC1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol
SMILESCC(O)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C10H16N4O/c1-9(15)13-5-7-14(8-6-13)10-11-3-2-4-12-10/h2-4,9,15H,5-8H2,1H3
InChIKeyBBRSTJNBIUCVJN-UHFFFAOYSA-N
MW208.27 g/mol
LogP-0.06
Rot. Bonds2

About 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol

1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol (PubChem CID 21279253) has the molecular formula C10H16N4O and a molecular weight of 208.27 g/mol. Its IUPAC name is 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol.

Molecular Properties

Compound Name1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol
PubChem CID21279253
Molecular FormulaC10H16N4O
Molecular Weight208.27 g/mol
Exact Mass208.13
IUPAC Name1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol
SMILESCC(O)N1CCN(c2ncccn2)CC1
InChIInChI=1S/C10H16N4O/c1-9(15)13-5-7-14(8-6-13)10-11-3-2-4-12-10/h2-4,9,15H,5-8H2,1H3
InChIKeyBBRSTJNBIUCVJN-UHFFFAOYSA-N
XLogP-0.06
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 3-(4-pyrimidin-2-ylpiperazin-1-yl)butanoate
CID 43537360
N-methyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-amine
CID 55070322
ethane;2-(4-methylpiperazin-1-yl)pyrimidine
CID 143004762
N-propan-2-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)butan-1-amine
CID 62425156
3-methyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)pentan-1-amine
CID 43312455
1-bromo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol
CID 112561188
N-phenyl-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 18078446
(2R)-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one
CID 8542107
2-amino-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one;dihydrochloride
CID 163198677
N-propan-2-yl-4-pyrimidin-2-ylpiperazine-1-carbothioamide
CID 2375700
2-(4-propan-2-ylsulfonylpiperazin-1-yl)pyrimidine
CID 47371249
(2R)-1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one
CID 8542153

Frequently Asked Questions

What is the IUPAC name of 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol?
The IUPAC name of 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol (CID 21279253) is 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol.
What is the SMILES notation for 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol?
The canonical SMILES for 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol is CC(O)N1CCN(c2ncccn2)CC1.
What is the InChIKey of 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol?
The InChIKey is BBRSTJNBIUCVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-9(15)13-5-7-14(8-6-13)10-11-3-2-4-12-10/h2-4,9,15H,5-8H2,1H3.
What are the key properties of 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol?
1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol has a molecular weight of 208.27 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanol is sourced from PubChem (CID 21279253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).