[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine

C13H18ClFN2O — CID 105272648

IUPAC[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine
SMILESCOC(C1CC1)C(Cc1cccc(F)c1Cl)NN
InChIInChI=1S/C13H18ClFN2O/c1-18-13(8-5-6-8)11(17-16)7-9-3-2-4-10(15)12(9)14/h2-4,8,11,13,17H,5-7,16H2,1H3
InChIKeyFTQVQQICRALVAG-UHFFFAOYSA-N
MW272.75 g/mol
LogP2.28
Rot. Bonds6

About [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine

[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine (PubChem CID 105272648) has the molecular formula C13H18ClFN2O and a molecular weight of 272.75 g/mol. Its IUPAC name is [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine.

Molecular Properties

Compound Name[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine
PubChem CID105272648
Molecular FormulaC13H18ClFN2O
Molecular Weight272.75 g/mol
Exact Mass272.11
IUPAC Name[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine
SMILESCOC(C1CC1)C(Cc1cccc(F)c1Cl)NN
InChIInChI=1S/C13H18ClFN2O/c1-18-13(8-5-6-8)11(17-16)7-9-3-2-4-10(15)12(9)14/h2-4,8,11,13,17H,5-7,16H2,1H3
InChIKeyFTQVQQICRALVAG-UHFFFAOYSA-N
XLogP2.28
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.75
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-chlorophenyl)-1-cyclohexyl-1-methoxypropan-2-yl]hydrazine
CID 105278665
[1-(2-chloro-3-fluorophenyl)-3-cyclobutylpropan-2-yl]hydrazine
CID 103170767
1-cyclopropyl-3-(2,6-difluorophenyl)-1-methoxy-N-methylpropan-2-amine
CID 114932663
[1-(3-chloro-2-fluorophenyl)-3-cyclopropylbutan-2-yl]hydrazine
CID 102868874
[3-(3-chloro-4-fluorophenyl)-1-cyclohexyl-1-methoxypropan-2-yl]hydrazine
CID 103044125
[2-(2-chloro-3-fluorophenyl)-1-(1-methoxy-4-methylcyclohexyl)ethyl]hydrazine
CID 105277013
3-(2-chloro-3-fluorophenyl)-1,1-dimethoxypropan-2-amine
CID 112653856
2-(2-chloro-3-fluorophenyl)-1-cyclobutyl-N-methylethanamine
CID 112653742
[3-(4-bromophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine
CID 105272881
[1-cyclohexyl-3-(4-fluorophenyl)-1-methoxypropan-2-yl]hydrazine
CID 105278577
[2-(2-chloro-3-fluorophenyl)-1-(1-methoxycyclobutyl)ethyl]hydrazine
CID 105270220
[2-(2-chloro-3-fluorophenyl)-1-(3-methyloxolan-2-yl)ethyl]hydrazine
CID 105332898

Frequently Asked Questions

What is the IUPAC name of [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine?
The IUPAC name of [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine (CID 105272648) is [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine.
What is the SMILES notation for [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine?
The canonical SMILES for [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine is COC(C1CC1)C(Cc1cccc(F)c1Cl)NN.
What is the InChIKey of [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine?
The InChIKey is FTQVQQICRALVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClFN2O/c1-18-13(8-5-6-8)11(17-16)7-9-3-2-4-10(15)12(9)14/h2-4,8,11,13,17H,5-7,16H2,1H3.
What are the key properties of [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine?
[3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine has a molecular weight of 272.75 g/mol, XLogP of 2.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-chloro-3-fluorophenyl)-1-cyclopropyl-1-methoxypropan-2-yl]hydrazine is sourced from PubChem (CID 105272648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).