[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine

C15H17ClN4O — CID 81001537

IUPAC[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
SMILESCc1c(NN)nc(C2CC2)nc1OCc1cccc(Cl)c1
InChIInChI=1S/C15H17ClN4O/c1-9-13(20-17)18-14(11-5-6-11)19-15(9)21-8-10-3-2-4-12(16)7-10/h2-4,7,11H,5-6,8,17H2,1H3,(H,18,19,20)
InChIKeyFSSBANVIKMDEIY-UHFFFAOYSA-N
MW304.78 g/mol
LogP3.18
Rot. Bonds5

About [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine

[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine (PubChem CID 81001537) has the molecular formula C15H17ClN4O and a molecular weight of 304.78 g/mol. Its IUPAC name is [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
PubChem CID81001537
Molecular FormulaC15H17ClN4O
Molecular Weight304.78 g/mol
Exact Mass304.11
IUPAC Name[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
SMILESCc1c(NN)nc(C2CC2)nc1OCc1cccc(Cl)c1
InChIInChI=1S/C15H17ClN4O/c1-9-13(20-17)18-14(11-5-6-11)19-15(9)21-8-10-3-2-4-12(16)7-10/h2-4,7,11H,5-6,8,17H2,1H3,(H,18,19,20)
InChIKeyFSSBANVIKMDEIY-UHFFFAOYSA-N
XLogP3.18
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 53.18
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

4-[(3-bromophenyl)methoxy]-6-chloro-2-cyclopropyl-5-methylpyrimidine
CID 82824304
4-chloro-2-cyclopropyl-5-methyl-6-phenylmethoxypyrimidine
CID 80974375
6-[(2-chlorophenyl)methoxy]-2-cyclopropyl-N,5-dimethylpyrimidin-4-amine
CID 80989714
[4-(2-cyclopropyl-6-hydrazinyl-5-methylpyrimidin-4-yl)oxyphenyl]methanol
CID 81000306
[6-[(3-bromophenyl)methoxy]-2-ethyl-5-methylpyrimidin-4-yl]hydrazine
CID 82825316
[2-cyclopropyl-6-(2,4-dibromophenoxy)-5-methylpyrimidin-4-yl]hydrazine
CID 81000209
2-cyclopropyl-N,5-dimethyl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990031
2-cyclopropyl-6-hydrazinyl-5-methyl-N-(3-methylphenyl)pyrimidin-4-amine
CID 81007517
(3,5-dichloro-6-phenylmethoxy-2-pyridinyl)hydrazine
CID 102762715
2-[(3-chlorophenyl)methoxy]-5-methylpyridin-3-amine
CID 66279132
[6-(4-chlorophenyl)sulfanyl-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine
CID 81001101
(7-chloro-2-cyclopropylquinazolin-4-yl)hydrazine
CID 106583896

Frequently Asked Questions

What is the IUPAC name of [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine?
The IUPAC name of [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine (CID 81001537) is [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine is Cc1c(NN)nc(C2CC2)nc1OCc1cccc(Cl)c1.
What is the InChIKey of [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine?
The InChIKey is FSSBANVIKMDEIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN4O/c1-9-13(20-17)18-14(11-5-6-11)19-15(9)21-8-10-3-2-4-12(16)7-10/h2-4,7,11H,5-6,8,17H2,1H3,(H,18,19,20).
What are the key properties of [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine?
[6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine has a molecular weight of 304.78 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(3-chlorophenyl)methoxy]-2-cyclopropyl-5-methylpyrimidin-4-yl]hydrazine is sourced from PubChem (CID 81001537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).