N'-(4-bromophenyl)cyclopentanecarboximidamide

C12H15BrN2 — CID 63178230

IUPACN'-(4-bromophenyl)cyclopentanecarboximidamide
SMILESN/C(=N\c1ccc(Br)cc1)C1CCCC1
InChIInChI=1S/C12H15BrN2/c13-10-5-7-11(8-6-10)15-12(14)9-3-1-2-4-9/h5-9H,1-4H2,(H2,14,15)
InChIKeyPEUAMBXXUXGMRO-UHFFFAOYSA-N
MW267.17 g/mol
LogP3.63
Rot. Bonds2

About N'-(4-bromophenyl)cyclopentanecarboximidamide

N'-(4-bromophenyl)cyclopentanecarboximidamide (PubChem CID 63178230) has the molecular formula C12H15BrN2 and a molecular weight of 267.17 g/mol. Its IUPAC name is N'-(4-bromophenyl)cyclopentanecarboximidamide.

Molecular Properties

Compound NameN'-(4-bromophenyl)cyclopentanecarboximidamide
PubChem CID63178230
Molecular FormulaC12H15BrN2
Molecular Weight267.17 g/mol
Exact Mass266.04
IUPAC NameN'-(4-bromophenyl)cyclopentanecarboximidamide
SMILESN/C(=N\c1ccc(Br)cc1)C1CCCC1
InChIInChI=1S/C12H15BrN2/c13-10-5-7-11(8-6-10)15-12(14)9-3-1-2-4-9/h5-9H,1-4H2,(H2,14,15)
InChIKeyPEUAMBXXUXGMRO-UHFFFAOYSA-N
XLogP3.63
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.17
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N'-(3,4-dichlorophenyl)cyclopentanecarboximidamide
CID 63178907
N'-(5-bromo-2-methylphenyl)cyclopentanecarboximidamide
CID 63175617
N'-(4-propan-2-yloxyphenyl)cyclopentanecarboximidamide
CID 63178568
N'-(5-bromo-2-methylphenyl)cyclohexanecarboximidamide
CID 63175680
N'-[4-[3-[4-[[amino(cyclohexyl)methylidene]amino]phenoxy]phenoxy]phenyl]cyclohexanecarboximidamide
CID 56933746
N'-naphthalen-2-ylcyclohexanecarboximidamide
CID 55158430
N'-[3-bromo-4-(trifluoromethoxy)phenyl]cyclopentanecarboximidamide
CID 107336768
N'-(4-phenylphenyl)cyclopropanecarboximidamide
CID 55160926
N'-(3,5-difluorophenyl)cyclopentanecarboximidamide
CID 63178820
N'-(3-bromo-5-methylphenyl)cyclopropanecarboximidamide
CID 107579403
3-[[amino(cyclopentyl)methylidene]amino]benzamide
CID 107811862
methyl N'-(4-bromophenyl)carbamimidate
CID 12624027

Frequently Asked Questions

What is the IUPAC name of N'-(4-bromophenyl)cyclopentanecarboximidamide?
The IUPAC name of N'-(4-bromophenyl)cyclopentanecarboximidamide (CID 63178230) is N'-(4-bromophenyl)cyclopentanecarboximidamide.
What is the SMILES notation for N'-(4-bromophenyl)cyclopentanecarboximidamide?
The canonical SMILES for N'-(4-bromophenyl)cyclopentanecarboximidamide is N/C(=N\c1ccc(Br)cc1)C1CCCC1.
What is the InChIKey of N'-(4-bromophenyl)cyclopentanecarboximidamide?
The InChIKey is PEUAMBXXUXGMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15BrN2/c13-10-5-7-11(8-6-10)15-12(14)9-3-1-2-4-9/h5-9H,1-4H2,(H2,14,15).
What are the key properties of N'-(4-bromophenyl)cyclopentanecarboximidamide?
N'-(4-bromophenyl)cyclopentanecarboximidamide has a molecular weight of 267.17 g/mol, XLogP of 3.63, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-bromophenyl)cyclopentanecarboximidamide is sourced from PubChem (CID 63178230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).