[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol

C15H18N4O2 — CID 81000306

IUPAC[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol
SMILESCc1c(NN)nc(C2CC2)nc1Oc1ccc(CO)cc1
InChIInChI=1S/C15H18N4O2/c1-9-13(19-16)17-14(11-4-5-11)18-15(9)21-12-6-2-10(8-20)3-7-12/h2-3,6-7,11,20H,4-5,8,16H2,1H3,(H,17,18,19)
InChIKeyIBHHFVCMOXGDBC-UHFFFAOYSA-N
MW286.34 g/mol
LogP2.23
Rot. Bonds5

About [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol

[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol (PubChem CID 81000306) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol.

Molecular Properties

Compound Name[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol
PubChem CID81000306
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol
SMILESCc1c(NN)nc(C2CC2)nc1Oc1ccc(CO)cc1
InChIInChI=1S/C15H18N4O2/c1-9-13(19-16)17-14(11-4-5-11)18-15(9)21-12-6-2-10(8-20)3-7-12/h2-3,6-7,11,20H,4-5,8,16H2,1H3,(H,17,18,19)
InChIKeyIBHHFVCMOXGDBC-UHFFFAOYSA-N
XLogP2.23
TPSA93.29 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 52.23
H-Bond Donors ≤ 53
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

[3-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol
CID 81000736
[2-cyclopropyl-5-methyl-6-(4-methylphenoxy)pyrimidin-4-yl]hydrazine
CID 81000617
[4-(6-amino-2-cyclopropyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol
CID 80990139
[6-(3-chlorophenoxy)-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
CID 81001078
[2-cyclopropyl-6-(2,4-dibromophenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 81000209
[2-cyclopropyl-6-(1-ethylpyrazol-4-yl)oxy-5-methylpyrimidin-4-yl]hydrazine
CID 116806787
2-cyclopropyl-6-(4-ethylphenoxy)-5-methylpyrimidin-4-amine
CID 80989231
[6-(5-chloro-2-methylphenoxy)-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
CID 81000980
[4-[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]oxyphenyl]methanol
CID 80870849
[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
CID 81001537
[2-cyclopropyl-5-methyl-6-(1,3,5-trimethylpyrazol-4-yl)oxypyrimidin-4-yl]hydrazine
CID 81000861
[2-cyclopropyl-5-methyl-6-(4-methylcyclohexyl)oxypyrimidin-4-yl]hydrazine
CID 81001809

Frequently Asked Questions

What is the IUPAC name of [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol?
The IUPAC name of [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol (CID 81000306) is [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol.
What is the SMILES notation for [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol?
The canonical SMILES for [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol is Cc1c(NN)nc(C2CC2)nc1Oc1ccc(CO)cc1.
What is the InChIKey of [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol?
The InChIKey is IBHHFVCMOXGDBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-9-13(19-16)17-14(11-4-5-11)18-15(9)21-12-6-2-10(8-20)3-7-12/h2-3,6-7,11,20H,4-5,8,16H2,1H3,(H,17,18,19).
What are the key properties of [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol?
[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol has a molecular weight of 286.34 g/mol, XLogP of 2.23, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol is sourced from PubChem (CID 81000306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).