N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide

C10H10Br2N2O — CID 43549427

IUPACN-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide
SMILESNc1cc(Br)c(NC(=O)C2CC2)c(Br)c1
InChIInChI=1S/C10H10Br2N2O/c11-7-3-6(13)4-8(12)9(7)14-10(15)5-1-2-5/h3-5H,1-2,13H2,(H,14,15)
InChIKeyKJVMYQABZUVVPK-UHFFFAOYSA-N
MW334.01 g/mol
LogP3.14
Rot. Bonds2

About N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide

N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide (PubChem CID 43549427) has the molecular formula C10H10Br2N2O and a molecular weight of 334.01 g/mol. Its IUPAC name is N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide
PubChem CID43549427
Molecular FormulaC10H10Br2N2O
Molecular Weight334.01 g/mol
Exact Mass331.92
IUPAC NameN-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide
SMILESNc1cc(Br)c(NC(=O)C2CC2)c(Br)c1
InChIInChI=1S/C10H10Br2N2O/c11-7-3-6(13)4-8(12)9(7)14-10(15)5-1-2-5/h3-5H,1-2,13H2,(H,14,15)
InChIKeyKJVMYQABZUVVPK-UHFFFAOYSA-N
XLogP3.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.01
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-2,6-dibromophenyl)cycloheptanecarboxamide
CID 62586302
N-(4-amino-2,6-dibromophenyl)oxolane-3-carboxamide
CID 61272365
N-(4-amino-2,6-dibromophenyl)-2-methylcyclopropane-1-carboxamide
CID 43549410
4-(aminomethyl)-N-(2,6-dibromo-4-methylphenyl)cyclohexane-1-carboxamide
CID 79526653
N-(4-amino-2-bromophenyl)cyclohexanecarboxamide
CID 1133414
N-(4-amino-2,6-dibromophenyl)azepane-1-carboxamide
CID 79151818
N-(4-amino-2,6-dibromophenyl)-3-cyclopentylpropanamide
CID 43549384
3-amino-N-(2,6-dibromo-4-methylphenyl)cyclohexane-1-carboxamide
CID 63041984
3-[(2,4,6-tribromophenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63788349
3,5-dibromo-2-(cycloheptanecarbonylamino)benzoic acid
CID 63405452
(3S)-N-(2,4,6-tribromophenyl)piperidine-3-carboxamide
CID 28992192
N-(4-amino-2-chloro-6-methylphenyl)cyclohexanecarboxamide
CID 100828283

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide?
The IUPAC name of N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide (CID 43549427) is N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide.
What is the SMILES notation for N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide?
The canonical SMILES for N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide is Nc1cc(Br)c(NC(=O)C2CC2)c(Br)c1.
What is the InChIKey of N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide?
The InChIKey is KJVMYQABZUVVPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Br2N2O/c11-7-3-6(13)4-8(12)9(7)14-10(15)5-1-2-5/h3-5H,1-2,13H2,(H,14,15).
What are the key properties of N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide?
N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide has a molecular weight of 334.01 g/mol, XLogP of 3.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,6-dibromophenyl)cyclopropanecarboxamide is sourced from PubChem (CID 43549427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).