[6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine

C16H20N4O — CID 63354426

IUPAC[6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine
SMILESCCCOc1cccc(-c2nc(NN)cc(C3CC3)n2)c1
InChIInChI=1S/C16H20N4O/c1-2-8-21-13-5-3-4-12(9-13)16-18-14(11-6-7-11)10-15(19-16)20-17/h3-5,9-11H,2,6-8,17H2,1H3,(H,18,19,20)
InChIKeyWUFBZRHFLDRJHQ-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.10
Rot. Bonds6

About [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine

[6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine (PubChem CID 63354426) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine
PubChem CID63354426
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name[6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine
SMILESCCCOc1cccc(-c2nc(NN)cc(C3CC3)n2)c1
InChIInChI=1S/C16H20N4O/c1-2-8-21-13-5-3-4-12(9-13)16-18-14(11-6-7-11)10-15(19-16)20-17/h3-5,9-11H,2,6-8,17H2,1H3,(H,18,19,20)
InChIKeyWUFBZRHFLDRJHQ-UHFFFAOYSA-N
XLogP3.10
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[6-cyclopropyl-2-(3-methoxyphenyl)pyrimidin-4-yl]hydrazine
CID 55189800
N,6-dimethyl-2-(3-propoxyphenyl)pyrimidin-4-amine
CID 62499474
[6-cyclopropyl-2-(4-ethylsulfanylphenyl)pyrimidin-4-yl]hydrazine
CID 106849612
2-cyclopropyl-4-(3-propoxyphenyl)imidazole-1,5-diamine
CID 62498323
[6-cyclopropyl-2-(4-fluoro-3-methylphenyl)pyrimidin-4-yl]hydrazine
CID 63354408
[6-cyclopropyl-2-(6-methoxy-2-pyridinyl)pyrimidin-4-yl]hydrazine
CID 103348476
6-cyclopropyl-N-ethyl-2-(3-methylphenyl)pyrimidin-4-amine
CID 63354393
3-[4-cyclopropyl-6-(propylamino)pyrimidin-2-yl]phenol
CID 63354599
[6-cyclopropyl-2-(2,6-dichlorophenyl)pyrimidin-4-yl]hydrazine
CID 55191217
5-iodo-6-methyl-2-(3-propoxyphenyl)pyrimidin-4-amine
CID 66296695
2-(3-propoxyphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 62500115
3-(4-cyclopropyl-6-propylpyrimidin-2-yl)aniline
CID 63319330

Frequently Asked Questions

What is the IUPAC name of [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine (CID 63354426) is [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine is CCCOc1cccc(-c2nc(NN)cc(C3CC3)n2)c1.
What is the InChIKey of [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine?
The InChIKey is WUFBZRHFLDRJHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-2-8-21-13-5-3-4-12(9-13)16-18-14(11-6-7-11)10-15(19-16)20-17/h3-5,9-11H,2,6-8,17H2,1H3,(H,18,19,20).
What are the key properties of [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine?
[6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine has a molecular weight of 284.36 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-cyclopropyl-2-(3-propoxyphenyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 63354426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).