N-(4-bromophenyl)formamide;methane

C8H10BrNO — CID 163289567

IUPACN-(4-bromophenyl)formamide;methane
SMILESC.O=CNc1ccc(Br)cc1
InChIInChI=1S/C7H6BrNO.CH4/c8-6-1-3-7(4-2-6)9-5-10;/h1-5H,(H,9,10);1H4
InChIKeyFVTNQRVFUILZAL-UHFFFAOYSA-N
MW216.08 g/mol
LogP2.65
Rot. Bonds2

About N-(4-bromophenyl)formamide;methane

N-(4-bromophenyl)formamide;methane (PubChem CID 163289567) has the molecular formula C8H10BrNO and a molecular weight of 216.08 g/mol. Its IUPAC name is N-(4-bromophenyl)formamide;methane.

Molecular Properties

Compound NameN-(4-bromophenyl)formamide;methane
PubChem CID163289567
Molecular FormulaC8H10BrNO
Molecular Weight216.08 g/mol
Exact Mass214.99
IUPAC NameN-(4-bromophenyl)formamide;methane
SMILESC.O=CNc1ccc(Br)cc1
InChIInChI=1S/C7H6BrNO.CH4/c8-6-1-3-7(4-2-6)9-5-10;/h1-5H,(H,9,10);1H4
InChIKeyFVTNQRVFUILZAL-UHFFFAOYSA-N
XLogP2.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.08
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(4-bromophenyl)formamide;methane 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

N-(4-formylphenyl)formamide
CID 15314216
ethane;N-(4-methylphenyl)formamide
CID 142066401
N-[4-[bis(4-formamidophenyl)methyl]phenyl]formamide
CID 22490733
N-[4-(4-methylphenyl)phenyl]formamide
CID 87370886
N-[4-(5-bromopyrimidin-2-yl)sulfanylphenyl]formamide
CID 168654215
N-[4-(4-bromopyrazol-1-yl)phenyl]formamide
CID 168652639
cesium;hydride;N-phenylformamide
CID 173414611
lithium;hydride;N-phenylformamide
CID 174281873
N-[3-(4-bromophenyl)sulfinamoyl-4-methoxyphenyl]formamide
CID 156859682
N-(3,5-diformamidophenyl)formamide
CID 87263269
N-[3-(4-bromoanilino)sulfanylphenyl]formamide;1,4-xylene
CID 170977109
ethane;N-(4-ethenylphenyl)formamide
CID 143911440

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)formamide;methane?
The IUPAC name of N-(4-bromophenyl)formamide;methane (CID 163289567) is N-(4-bromophenyl)formamide;methane.
What is the SMILES notation for N-(4-bromophenyl)formamide;methane?
The canonical SMILES for N-(4-bromophenyl)formamide;methane is C.O=CNc1ccc(Br)cc1.
What is the InChIKey of N-(4-bromophenyl)formamide;methane?
The InChIKey is FVTNQRVFUILZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrNO.CH4/c8-6-1-3-7(4-2-6)9-5-10;/h1-5H,(H,9,10);1H4.
What are the key properties of N-(4-bromophenyl)formamide;methane?
N-(4-bromophenyl)formamide;methane has a molecular weight of 216.08 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)formamide;methane is sourced from PubChem (CID 163289567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).