N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide

C10H10ClFN2 — CID 63178409

IUPACN'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide
SMILESN/C(=N\c1cccc(Cl)c1F)C1CC1
InChIInChI=1S/C10H10ClFN2/c11-7-2-1-3-8(9(7)12)14-10(13)6-4-5-6/h1-3,6H,4-5H2,(H2,13,14)
InChIKeyBWUGPUQFPNQUTQ-UHFFFAOYSA-N
MW212.66 g/mol
LogP2.88
Rot. Bonds2

About N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide

N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide (PubChem CID 63178409) has the molecular formula C10H10ClFN2 and a molecular weight of 212.66 g/mol. Its IUPAC name is N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide
PubChem CID63178409
Molecular FormulaC10H10ClFN2
Molecular Weight212.66 g/mol
Exact Mass212.05
IUPAC NameN'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide
SMILESN/C(=N\c1cccc(Cl)c1F)C1CC1
InChIInChI=1S/C10H10ClFN2/c11-7-2-1-3-8(9(7)12)14-10(13)6-4-5-6/h1-3,6H,4-5H2,(H2,13,14)
InChIKeyBWUGPUQFPNQUTQ-UHFFFAOYSA-N
XLogP2.88
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.66
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide?
The IUPAC name of N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide (CID 63178409) is N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide.
What is the SMILES notation for N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide?
The canonical SMILES for N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide is N/C(=N\c1cccc(Cl)c1F)C1CC1.
What is the InChIKey of N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide?
The InChIKey is BWUGPUQFPNQUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFN2/c11-7-2-1-3-8(9(7)12)14-10(13)6-4-5-6/h1-3,6H,4-5H2,(H2,13,14).
What are the key properties of N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide?
N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide has a molecular weight of 212.66 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-chloro-2-fluorophenyl)cyclopropanecarboximidamide is sourced from PubChem (CID 63178409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).