4-bromo-N-(cyclohexylideneamino)aniline

C12H15BrN2 — CID 4167253

IUPAC4-bromo-N-(cyclohexylideneamino)aniline
SMILESBrc1ccc(NN=C2CCCCC2)cc1
InChIInChI=1S/C12H15BrN2/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h6-9,15H,1-5H2
InChIKeyBIWLMPOYJZOVQD-UHFFFAOYSA-N
MW267.17 g/mol
LogP4.18
Rot. Bonds2

About 4-bromo-N-(cyclohexylideneamino)aniline

4-bromo-N-(cyclohexylideneamino)aniline (PubChem CID 4167253) has the molecular formula C12H15BrN2 and a molecular weight of 267.17 g/mol. Its IUPAC name is 4-bromo-N-(cyclohexylideneamino)aniline.

Molecular Properties

Compound Name4-bromo-N-(cyclohexylideneamino)aniline
PubChem CID4167253
Molecular FormulaC12H15BrN2
Molecular Weight267.17 g/mol
Exact Mass266.04
IUPAC Name4-bromo-N-(cyclohexylideneamino)aniline
SMILESBrc1ccc(NN=C2CCCCC2)cc1
InChIInChI=1S/C12H15BrN2/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h6-9,15H,1-5H2
InChIKeyBIWLMPOYJZOVQD-UHFFFAOYSA-N
XLogP4.18
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.17
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(4-bromophenyl)hydrazinylidene]cyclohexan-1-one
CID 56623987
2,4-dibromo-N-(cyclohexylideneamino)aniline
CID 121012278
N-(cyclohexylideneamino)-4-nitroaniline
CID 616169
N-(cyclohexylideneamino)-4-(2-cyclohexylidenehydrazinyl)benzamide
CID 5074578
4-(2-cyclopentylidenehydrazinyl)benzenesulfonamide
CID 139083383
4-bromo-N-(cyclooctylideneamino)benzenesulfonamide
CID 1012381
(3Z)-3-[(4-bromophenyl)hydrazinylidene]piperidin-2-one;ethane
CID 143961711
3-bromo-N-[[3-[(3-bromophenyl)hydrazinylidene]cyclohexylidene]amino]aniline
CID 123597481
2-[(4-bromophenyl)hydrazinylidene]-4-methylcyclohept-3-en-1-one
CID 123259727
N-(cyclododecylideneamino)-3-nitroaniline
CID 4035355
disodium;4-[2-[4-[(4-sulfonatophenyl)hydrazinylidene]cyclohexylidene]hydrazinyl]benzenesulfonate
CID 2831877
1-bromo-2-(4-bromophenyl)hydrazine;hydrochloride
CID 174886915

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(cyclohexylideneamino)aniline?
The IUPAC name of 4-bromo-N-(cyclohexylideneamino)aniline (CID 4167253) is 4-bromo-N-(cyclohexylideneamino)aniline.
What is the SMILES notation for 4-bromo-N-(cyclohexylideneamino)aniline?
The canonical SMILES for 4-bromo-N-(cyclohexylideneamino)aniline is Brc1ccc(NN=C2CCCCC2)cc1.
What is the InChIKey of 4-bromo-N-(cyclohexylideneamino)aniline?
The InChIKey is BIWLMPOYJZOVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15BrN2/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h6-9,15H,1-5H2.
What are the key properties of 4-bromo-N-(cyclohexylideneamino)aniline?
4-bromo-N-(cyclohexylideneamino)aniline has a molecular weight of 267.17 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-(cyclohexylideneamino)aniline is sourced from PubChem (CID 4167253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).