N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide

C14H19FIN3O — CID 119120458

IUPACN'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide
SMILESI.N/C(=N\C1CC1c1cccc(F)c1)N1CCOCC1
InChIInChI=1S/C14H18FN3O.HI/c15-11-3-1-2-10(8-11)12-9-13(12)17-14(16)18-4-6-19-7-5-18;/h1-3,8,12-13H,4-7,9H2,(H2,16,17);1H
InChIKeyMGRFKJHVNPKBTR-UHFFFAOYSA-N
MW391.23 g/mol
LogP1.95
Rot. Bonds2

About N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide

N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide (PubChem CID 119120458) has the molecular formula C14H19FIN3O and a molecular weight of 391.23 g/mol. Its IUPAC name is N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide.

Molecular Properties

Compound NameN'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide
PubChem CID119120458
Molecular FormulaC14H19FIN3O
Molecular Weight391.23 g/mol
Exact Mass391.06
IUPAC NameN'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide
SMILESI.N/C(=N\C1CC1c1cccc(F)c1)N1CCOCC1
InChIInChI=1S/C14H18FN3O.HI/c15-11-3-1-2-10(8-11)12-9-13(12)17-14(16)18-4-6-19-7-5-18;/h1-3,8,12-13H,4-7,9H2,(H2,16,17);1H
InChIKeyMGRFKJHVNPKBTR-UHFFFAOYSA-N
XLogP1.95
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.23
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide 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

N'-[(1R,2S)-2-(3-fluorophenyl)cyclopropyl]azepane-1-carboximidamide
CID 120606046
N'-[2-(2-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide
CID 111101017
N'-[(1R,2S,3S)-2-methyl-3-phenylcyclobutyl]morpholine-4-carboximidamide
CID 99849055
N'-[(1R,2S)-2-(4-fluorophenyl)cyclopropyl]thiomorpholine-4-carboximidamide;hydroiodide
CID 120606097
N'-[(1R,2S)-2-(3-chlorophenyl)cyclopropyl]-2-methylmorpholine-4-carboximidamide
CID 120671238
N'-[3-[3-(trifluoromethyl)phenyl]cyclobutyl]morpholine-4-carboximidamide;hydroiodide
CID 120671720
N'-[2-(2,6-difluorophenyl)cyclopropyl]piperidine-1-carboximidamide
CID 111815372
N'-[(1R,2S)-2-(3-ethoxyphenyl)cyclopropyl]-2-methylmorpholine-4-carboximidamide
CID 120671174
[4-(3-fluorophenyl)pyrrolidin-3-yl]-morpholin-4-ylmethanone
CID 42680068
N'-[(1R,2S)-2-(3-methoxyphenyl)cyclopropyl]-3-methylpiperidine-1-carboximidamide
CID 122097958
N'-[(1R,2S)-2-(3,4-dichlorophenyl)cyclopropyl]azetidine-1-carboximidamide
CID 122095835
N'-[2-(3-fluorophenoxy)propyl]morpholine-4-carboximidamide
CID 111820472

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide?
The IUPAC name of N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide (CID 119120458) is N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide.
What is the SMILES notation for N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide?
The canonical SMILES for N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide is I.N/C(=N\C1CC1c1cccc(F)c1)N1CCOCC1.
What is the InChIKey of N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide?
The InChIKey is MGRFKJHVNPKBTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O.HI/c15-11-3-1-2-10(8-11)12-9-13(12)17-14(16)18-4-6-19-7-5-18;/h1-3,8,12-13H,4-7,9H2,(H2,16,17);1H.
What are the key properties of N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide?
N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide has a molecular weight of 391.23 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-fluorophenyl)cyclopropyl]morpholine-4-carboximidamide;hydroiodide is sourced from PubChem (CID 119120458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).