2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol

C10H13N5O — CID 141287434

IUPAC2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
SMILESCc1cnc(Nc2cnn(CCO)c2)nc1
InChIInChI=1S/C10H13N5O/c1-8-4-11-10(12-5-8)14-9-6-13-15(7-9)2-3-16/h4-7,16H,2-3H2,1H3,(H,11,12,14)
InChIKeyNKDDOCRZILMGEG-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.72
Rot. Bonds4

About 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol

2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol (PubChem CID 141287434) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
PubChem CID141287434
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
SMILESCc1cnc(Nc2cnn(CCO)c2)nc1
InChIInChI=1S/C10H13N5O/c1-8-4-11-10(12-5-8)14-9-6-13-15(7-9)2-3-16/h4-7,16H,2-3H2,1H3,(H,11,12,14)
InChIKeyNKDDOCRZILMGEG-UHFFFAOYSA-N
XLogP0.72
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

ethane;2-[4-(methylamino)pyrazol-1-yl]ethanol
CID 171834591
2-[4-[[1-[(2-fluorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-6-yl]amino]pyrazol-1-yl]ethanol
CID 52914629
2-[4-(2-methylpropylamino)pyrazol-1-yl]ethanol;hydrochloride
CID 126964216
2-[4-(butan-2-ylamino)pyrazol-1-yl]ethanol
CID 115922691
[4-[2-[[1-(2-hydroxyethyl)pyrazol-4-yl]amino]pyrimidin-4-yl]-2-methylphenyl]methylazanium
CID 163700476
methyl 4-[5-fluoro-2-[[1-(2-hydroxyethyl)pyrazol-4-yl]amino]pyrimidin-4-yl]benzoate
CID 154940247
3-[4-[(5-iodopyrimidin-2-yl)amino]pyrazol-1-yl]propanenitrile
CID 154640529
2-[4-[(5-bromo-6-methyl-2-propan-2-ylpyrimidin-4-yl)amino]pyrazol-1-yl]ethanol
CID 146145489
N-(1-cyanoethyl)-4-[2-[[1-(2-hydroxyethyl)pyrazol-4-yl]amino]-5-methylpyrimidin-4-yl]benzamide
CID 165161627
(2R)-2-ethyl-4-[4-[2-[[1-(2-hydroxyethyl)pyrazol-4-yl]amino]-5-methylpyrimidin-4-yl]phenyl]-4-oxobutanenitrile
CID 167632838
2-[4-[(1-ethylpyrazol-4-yl)methylamino]pyrazol-1-yl]ethanol
CID 122166813
2-[4-[[4-(cyclohexylamino)thieno[3,2-d]pyrimidin-2-yl]amino]pyrazol-1-yl]ethanol
CID 155348465

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol (CID 141287434) is 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol is Cc1cnc(Nc2cnn(CCO)c2)nc1.
What is the InChIKey of 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
The InChIKey is NKDDOCRZILMGEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-8-4-11-10(12-5-8)14-9-6-13-15(7-9)2-3-16/h4-7,16H,2-3H2,1H3,(H,11,12,14).
What are the key properties of 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol has a molecular weight of 219.25 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(5-methylpyrimidin-2-yl)amino]pyrazol-1-yl]ethanol is sourced from PubChem (CID 141287434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).