2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol

C15H21N5O — CID 81006900

IUPAC2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol
SMILESCCc1nc(NN)c(C)c(NC(CO)c2ccccc2)n1
InChIInChI=1S/C15H21N5O/c1-3-13-18-14(10(2)15(19-13)20-16)17-12(9-21)11-7-5-4-6-8-11/h4-8,12,21H,3,9,16H2,1-2H3,(H2,17,18,19,20)
InChIKeyBIMFNUOZNUGRQV-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.78
Rot. Bonds6

About 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol

2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol (PubChem CID 81006900) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol.

Molecular Properties

Compound Name2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol
PubChem CID81006900
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol
SMILESCCc1nc(NN)c(C)c(NC(CO)c2ccccc2)n1
InChIInChI=1S/C15H21N5O/c1-3-13-18-14(10(2)15(19-13)20-16)17-12(9-21)11-7-5-4-6-8-11/h4-8,12,21H,3,9,16H2,1-2H3,(H2,17,18,19,20)
InChIKeyBIMFNUOZNUGRQV-UHFFFAOYSA-N
XLogP1.78
TPSA96.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[[5-methyl-6-(propylamino)pyrimidin-4-yl]amino]-2-phenylethanol
CID 80812449
(2S)-2-[(6-ethyl-2-methylpyrimidin-4-yl)amino]-2-phenylethanol
CID 133460882
2-ethyl-6-hydrazinyl-N-(2-iodophenyl)-5-methylpyrimidin-4-amine
CID 81007542
2-[(3-methylquinolin-2-yl)amino]-2-phenylethanol
CID 63228896
[2-ethyl-5-methyl-6-(2-methylphenyl)sulfanylpyrimidin-4-yl]hydrazine
CID 81001116
(2R)-2-[(5-chloro-2-methylpyrimidin-4-yl)amino]-2-phenylethanol
CID 135104502
2-[(6-methyl-2-pyridinyl)amino]-2-phenylethanol
CID 63183355
6-N-ethyl-2,5-dimethyl-4-N-(1-phenylpropyl)pyrimidine-4,6-diamine
CID 80798116
[2-ethyl-5-methyl-6-(2-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 81000967
2-[[6-(ethylamino)-2-pyridinyl]amino]-2-phenylethanol
CID 80827704
2-(hydroxyamino)-2-phenylethanol
CID 12782000
(2S)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-phenylethanol
CID 46213032

Frequently Asked Questions

What is the IUPAC name of 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol?
The IUPAC name of 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol (CID 81006900) is 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol.
What is the SMILES notation for 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol?
The canonical SMILES for 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol is CCc1nc(NN)c(C)c(NC(CO)c2ccccc2)n1.
What is the InChIKey of 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol?
The InChIKey is BIMFNUOZNUGRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-3-13-18-14(10(2)15(19-13)20-16)17-12(9-21)11-7-5-4-6-8-11/h4-8,12,21H,3,9,16H2,1-2H3,(H2,17,18,19,20).
What are the key properties of 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol?
2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol has a molecular weight of 287.37 g/mol, XLogP of 1.78, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-ethyl-6-hydrazinyl-5-methylpyrimidin-4-yl)amino]-2-phenylethanol is sourced from PubChem (CID 81006900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).