2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol

C8H14N4O — CID 83876127

IUPAC2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol
SMILESCN(C)c1nccc(C(O)CN)n1
InChIInChI=1S/C8H14N4O/c1-12(2)8-10-4-3-6(11-8)7(13)5-9/h3-4,7,13H,5,9H2,1-2H3
InChIKeyZYCDUSHROXOJQN-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.47
Rot. Bonds3

About 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol

2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol (PubChem CID 83876127) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol.

Molecular Properties

Compound Name2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol
PubChem CID83876127
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol
SMILESCN(C)c1nccc(C(O)CN)n1
InChIInChI=1S/C8H14N4O/c1-12(2)8-10-4-3-6(11-8)7(13)5-9/h3-4,7,13H,5,9H2,1-2H3
InChIKeyZYCDUSHROXOJQN-UHFFFAOYSA-N
XLogP-0.47
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-4-propan-2-ylpyrimidin-2-amine
CID 10820941
diethyl 2-[2-(dimethylamino)pyrimidin-4-yl]propanedioate
CID 104573510
2-amino-1-(4-methyl-2-pyridinyl)ethanol;dihydrochloride
CID 71742337
2-amino-1-[4-cyclopropyl-2-(dimethylamino)pyrimidin-5-yl]ethanol
CID 83890724
(1S)-2-amino-1-[3-(dimethylamino)-1,2,4-oxadiazol-5-yl]ethanol
CID 107837369
3-bromo-2-[2-(dimethylamino)pyrimidin-4-yl]propanenitrile
CID 64830112
2-amino-1-[4-(1-aminopropyl)pyrimidin-2-yl]ethanol
CID 82399491
4-amino-1-(2-methylpyrimidin-4-yl)butan-1-ol
CID 82408295
(1S)-2-amino-1-quinolin-2-ylethanol
CID 96808696
4-[2-(ethylamino)pentan-3-yl]-N,N-dimethylpyrimidin-2-amine
CID 64830506
2-amino-1-(6-chloro-2-pyridinyl)ethanol
CID 14578852
3-[2-(dimethylamino)pyrimidin-4-yl]sulfanylpropane-1,2-diol
CID 79682622

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol?
The IUPAC name of 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol (CID 83876127) is 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol.
What is the SMILES notation for 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol?
The canonical SMILES for 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol is CN(C)c1nccc(C(O)CN)n1.
What is the InChIKey of 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol?
The InChIKey is ZYCDUSHROXOJQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-12(2)8-10-4-3-6(11-8)7(13)5-9/h3-4,7,13H,5,9H2,1-2H3.
What are the key properties of 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol?
2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol has a molecular weight of 182.23 g/mol, XLogP of -0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[2-(dimethylamino)pyrimidin-4-yl]ethanol is sourced from PubChem (CID 83876127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).