1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride

C10H10ClF2IN2O — CID 119764585

IUPAC1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)Nc2cc(F)c(I)c(F)c2)CC1
InChIInChI=1S/C10H9F2IN2O.ClH/c11-6-3-5(4-7(12)8(6)13)15-9(16)10(14)1-2-10;/h3-4H,1-2,14H2,(H,15,16);1H
InChIKeyWWFREWVKJOVGRL-UHFFFAOYSA-N
MW374.56 g/mol
LogP2.42
Rot. Bonds2

About 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride

1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride (PubChem CID 119764585) has the molecular formula C10H10ClF2IN2O and a molecular weight of 374.56 g/mol. Its IUPAC name is 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride
PubChem CID119764585
Molecular FormulaC10H10ClF2IN2O
Molecular Weight374.56 g/mol
Exact Mass373.95
IUPAC Name1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)Nc2cc(F)c(I)c(F)c2)CC1
InChIInChI=1S/C10H9F2IN2O.ClH/c11-6-3-5(4-7(12)8(6)13)15-9(16)10(14)1-2-10;/h3-4H,1-2,14H2,(H,15,16);1H
InChIKeyWWFREWVKJOVGRL-UHFFFAOYSA-N
XLogP2.42
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.56
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride 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

1-amino-N-(3,5-difluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119696869
1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119708317
1-amino-N-(3,5-difluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119275249
1-amino-N-(3-fluoro-4-methylphenyl)cyclopropane-1-carboxamide
CID 65465257
1-amino-N-(3,5-dimethylphenyl)cyclopropane-1-carboxamide
CID 65465042
1-amino-N-(4-bromo-3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119280057
1-amino-N-phenylcyclopropane-1-carboxamide;hydrochloride
CID 75467843
1-amino-N-(3,5-dichloro-4-fluorophenyl)cyclopentane-1-carboxamide
CID 107574361
1-amino-N-(4-chloro-3-fluorophenyl)cyclobutane-1-carboxamide
CID 81179055
1-amino-N-(4-bromo-3-fluorophenyl)cyclohexane-1-carboxamide
CID 65436937
1-amino-N-(3,5-dichloro-4-fluorophenyl)cyclohexane-1-carboxamide
CID 107574452
1-amino-N-(3-bromo-4-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119281111

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride (CID 119764585) is 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride is Cl.NC1(C(=O)Nc2cc(F)c(I)c(F)c2)CC1.
What is the InChIKey of 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is WWFREWVKJOVGRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2IN2O.ClH/c11-6-3-5(4-7(12)8(6)13)15-9(16)10(14)1-2-10;/h3-4H,1-2,14H2,(H,15,16);1H.
What are the key properties of 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride?
1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 374.56 g/mol, XLogP of 2.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119764585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).