N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide

C9H11FN2 — CID 27509

IUPACN'-(4-fluorophenyl)-N,N-dimethylmethanimidamide
SMILESCN(C)/C=N/c1ccc(F)cc1
InChIInChI=1S/C9H11FN2/c1-12(2)7-11-9-5-3-8(10)4-6-9/h3-7H,1-2H3/b11-7+
InChIKeyZUXFGHXKHKTCRP-YRNVUSSQSA-N
MW166.20 g/mol
LogP2.05
Rot. Bonds2

About N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide

N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide (PubChem CID 27509) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-(4-fluorophenyl)-N,N-dimethylmethanimidamide
PubChem CID27509
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC NameN'-(4-fluorophenyl)-N,N-dimethylmethanimidamide
SMILESCN(C)/C=N/c1ccc(F)cc1
InChIInChI=1S/C9H11FN2/c1-12(2)7-11-9-5-3-8(10)4-6-9/h3-7H,1-2H3/b11-7+
InChIKeyZUXFGHXKHKTCRP-YRNVUSSQSA-N
XLogP2.05
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Phenylbiguanide
CID 4780
N-Phenylguanidine
CID 16157
N,N-Dimethyl-N'-phenylmethanimidamide
CID 15692
N,N-Dimethyl-N'-(2-methylphenyl)methanimidamide
CID 25123
BIGUANIDE, 1-(p-FLUOROPHENYL)-, MONOHYDROCHLORIDE
CID 10537511
N-Cyano-N'-phenylformimidamide
CID 318808
(1E)-N'-(4-Fluorophenyl)ethanimidamide
CID 13268358
(2E)-2-hydroxyimino-N,N-dimethyl-N'-phenylethanimidamide;hydrochloride
CID 136152733
1-(4-Fluorophenyl)guanidine
CID 1549311
3,3-Dimethyl-1-(4-fluorophenyl)triazene
CID 90106
1-(4-Fluorophenyl)biguanide hydrochloride
CID 11424753
1-[bis(dimethylamino)phosphinothioyl]-N,N-dimethyl-N'-phenylmethanimidamide
CID 4058161

Frequently Asked Questions

What is the IUPAC name of N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide?
The IUPAC name of N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide (CID 27509) is N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide is CN(C)/C=N/c1ccc(F)cc1.
What is the InChIKey of N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide?
The InChIKey is ZUXFGHXKHKTCRP-YRNVUSSQSA-N. The full InChI is InChI=1S/C9H11FN2/c1-12(2)7-11-9-5-3-8(10)4-6-9/h3-7H,1-2H3/b11-7+.
What are the key properties of N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide?
N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide has a molecular weight of 166.20 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-fluorophenyl)-N,N-dimethylmethanimidamide is sourced from PubChem (CID 27509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).