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

C9H10FN5O — CID 141287446

IUPAC2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
SMILESOCCn1cc(Nc2ncc(F)cn2)cn1
InChIInChI=1S/C9H10FN5O/c10-7-3-11-9(12-4-7)14-8-5-13-15(6-8)1-2-16/h3-6,16H,1-2H2,(H,11,12,14)
InChIKeyGVNPXOMXGUJMSW-UHFFFAOYSA-N
MW223.21 g/mol
LogP0.55
Rot. Bonds4

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

2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol (PubChem CID 141287446) has the molecular formula C9H10FN5O and a molecular weight of 223.21 g/mol. Its IUPAC name is 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
PubChem CID141287446
Molecular FormulaC9H10FN5O
Molecular Weight223.21 g/mol
Exact Mass223.09
IUPAC Name2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol
SMILESOCCn1cc(Nc2ncc(F)cn2)cn1
InChIInChI=1S/C9H10FN5O/c10-7-3-11-9(12-4-7)14-8-5-13-15(6-8)1-2-16/h3-6,16H,1-2H2,(H,11,12,14)
InChIKeyGVNPXOMXGUJMSW-UHFFFAOYSA-N
XLogP0.55
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.21
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(6-Pyrazol-1-ylpyrimidin-4-yl)amino]ethanol
CID 2218330
5-fluoro-N-[1-(2-piperidin-1-ylethyl)pyrazol-4-yl]pyrimidin-2-amine
CID 121560827
1-[4-[4-(5-Fluoropyrimidin-2-yl)piperazin-1-yl]butyl]pyrazol-4-amine
CID 59144901
5-fluoro-N-(1-methylpyrazol-4-yl)pyrimidin-2-amine
CID 115749967
N-(1-ethylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidin-2-amine
CID 141287435
N-(1-methylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidin-2-amine
CID 141287440
2-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-5-methylpyrimidine-2,4-diamine
CID 141357970
N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-5-methylpyrimidin-2-amine
CID 141373137
5-fluoro-2-N-(1-methylpyrazol-4-yl)pyrimidine-2,4-diamine
CID 141373154
4-N-methyl-2-N-[1-[2-(2-propoxyethylamino)ethyl]pyrazol-4-yl]-5-(trifluoromethyl)pyrimidine-2,4-diamine
CID 146292932
5-methanimidoyl-2-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]pyrimidine-2,4,6-triamine
CID 148223365
2-(4-Fluoropyrazol-1-yl)pyrimidin-5-amine
CID 151007927

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol (CID 141287446) is 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol is OCCn1cc(Nc2ncc(F)cn2)cn1.
What is the InChIKey of 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
The InChIKey is GVNPXOMXGUJMSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN5O/c10-7-3-11-9(12-4-7)14-8-5-13-15(6-8)1-2-16/h3-6,16H,1-2H2,(H,11,12,14).
What are the key properties of 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol?
2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol has a molecular weight of 223.21 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(5-fluoropyrimidin-2-yl)amino]pyrazol-1-yl]ethanol is sourced from PubChem (CID 141287446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).