N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide

C11H13FN2 — CID 63178403

IUPACN'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide
SMILESCc1ccc(/N=C(\N)C2CC2)c(F)c1
InChIInChI=1S/C11H13FN2/c1-7-2-5-10(9(12)6-7)14-11(13)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H2,13,14)
InChIKeySKBIBBYTLFQLHJ-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.53
Rot. Bonds2

About N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide

N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide (PubChem CID 63178403) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide.

Molecular Properties

Compound NameN'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide
PubChem CID63178403
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC NameN'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide
SMILESCc1ccc(/N=C(\N)C2CC2)c(F)c1
InChIInChI=1S/C11H13FN2/c1-7-2-5-10(9(12)6-7)14-11(13)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H2,13,14)
InChIKeySKBIBBYTLFQLHJ-UHFFFAOYSA-N
XLogP2.53
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.53
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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Related Compounds

N'-(2,3,5-trifluorophenyl)cyclopropanecarboximidamide
CID 63174221
N'-(4-chloro-2-methylphenyl)cyclohexanecarboximidamide
CID 114256582
N'-(4-chloro-2-iodophenyl)cyclopropanecarboximidamide
CID 107638264
N'-(2,3-dimethylphenyl)cyclopropanecarboximidamide
CID 63178452
N'-(2-fluoro-4-methylphenyl)-6-methylpyridine-3-carboximidamide
CID 134569619
1-(2-fluoro-5-methylbenzoyl)-N'-hydroxypiperidine-4-carboximidamide
CID 77038997
1-amino-2-(2-fluoro-4-methylphenyl)-3-phenylguanidine
CID 116512637
N'-[2-fluoro-5-(trifluoromethyl)phenyl]cyclopentanecarboximidamide
CID 63181253
N'-(3-bromo-5-methylphenyl)cyclopropanecarboximidamide
CID 107579403
N'-(5-bromo-2-methylphenyl)cyclopentanecarboximidamide
CID 63175617
ethane;N'-(2-fluoro-4-methylphenyl)-3-oxopropanimidamide;methoxyethane
CID 143666986
1-(2-fluoro-4-methylbenzoyl)-6-methylpiperidine-3-carboxamide
CID 79777604

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide?
The IUPAC name of N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide (CID 63178403) is N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide.
What is the SMILES notation for N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide?
The canonical SMILES for N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide is Cc1ccc(/N=C(\N)C2CC2)c(F)c1.
What is the InChIKey of N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide?
The InChIKey is SKBIBBYTLFQLHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-7-2-5-10(9(12)6-7)14-11(13)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H2,13,14).
What are the key properties of N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide?
N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide has a molecular weight of 192.24 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluoro-4-methylphenyl)cyclopropanecarboximidamide is sourced from PubChem (CID 63178403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).