1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride

C10H11Cl2FN2O — CID 119708317

IUPAC1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)Nc2ccc(Cl)c(F)c2)CC1
InChIInChI=1S/C10H10ClFN2O.ClH/c11-7-2-1-6(5-8(7)12)14-9(15)10(13)3-4-10;/h1-2,5H,3-4,13H2,(H,14,15);1H
InChIKeyVBAMBZKBXZWGBX-UHFFFAOYSA-N
MW265.12 g/mol
LogP2.33
Rot. Bonds2

About 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride

1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride (PubChem CID 119708317) has the molecular formula C10H11Cl2FN2O and a molecular weight of 265.12 g/mol. Its IUPAC name is 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride
PubChem CID119708317
Molecular FormulaC10H11Cl2FN2O
Molecular Weight265.12 g/mol
Exact Mass264.02
IUPAC Name1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride
SMILESCl.NC1(C(=O)Nc2ccc(Cl)c(F)c2)CC1
InChIInChI=1S/C10H10ClFN2O.ClH/c11-7-2-1-6(5-8(7)12)14-9(15)10(13)3-4-10;/h1-2,5H,3-4,13H2,(H,14,15);1H
InChIKeyVBAMBZKBXZWGBX-UHFFFAOYSA-N
XLogP2.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.12
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 81179055
1-(aminomethyl)-N-(4-chloro-3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119708329
5-[(1-aminocyclopropanecarbonyl)amino]-2-chlorobenzoic acid
CID 65464876
1-amino-N-(3-fluoro-4-methylphenyl)cyclopropane-1-carboxamide
CID 65465257
1-amino-N-(4-bromo-3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119280057
1-amino-N-(3,5-difluoro-4-iodophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119764585
N-(4-chloro-3-fluorophenyl)-1-[(E)-N'-hydroxycarbamimidoyl]cyclopropane-1-carboxamide
CID 80597009
1-amino-N-[4-chloro-3-(methylsulfinylmethyl)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119790098
1-amino-N-(3,5-difluorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119696869
1-amino-N-(4-bromo-3-fluorophenyl)cyclohexane-1-carboxamide
CID 65436937
N-(4-chloro-3-fluorophenyl)-4-methoxypiperidine-4-carboxamide;hydrochloride
CID 119708344
N-(4-chloro-3-fluorophenyl)acetamide
CID 60776248

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride (CID 119708317) is 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride is Cl.NC1(C(=O)Nc2ccc(Cl)c(F)c2)CC1.
What is the InChIKey of 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is VBAMBZKBXZWGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFN2O.ClH/c11-7-2-1-6(5-8(7)12)14-9(15)10(13)3-4-10;/h1-2,5H,3-4,13H2,(H,14,15);1H.
What are the key properties of 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride?
1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 265.12 g/mol, XLogP of 2.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-(4-chloro-3-fluorophenyl)cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119708317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).