N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine

C15H26BrN — CID 113464984

IUPACN-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine
SMILESC=C(Br)CNC1CCCCC1C1CCCCC1
InChIInChI=1S/C15H26BrN/c1-12(16)11-17-15-10-6-5-9-14(15)13-7-3-2-4-8-13/h13-15,17H,1-11H2
InChIKeyYXTBQCATXHTWHQ-UHFFFAOYSA-N
MW300.28 g/mol
LogP4.62
Rot. Bonds4

About N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine

N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine (PubChem CID 113464984) has the molecular formula C15H26BrN and a molecular weight of 300.28 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine
PubChem CID113464984
Molecular FormulaC15H26BrN
Molecular Weight300.28 g/mol
Exact Mass299.12
IUPAC NameN-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine
SMILESC=C(Br)CNC1CCCCC1C1CCCCC1
InChIInChI=1S/C15H26BrN/c1-12(16)11-17-15-10-6-5-9-14(15)13-7-3-2-4-8-13/h13-15,17H,1-11H2
InChIKeyYXTBQCATXHTWHQ-UHFFFAOYSA-N
XLogP4.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.28
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine 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

2-cyclohexyl-N-(3-methylbut-2-enyl)cyclohexan-1-amine
CID 106180008
N-(2-bromoprop-2-enyl)-2-propan-2-ylcyclohexan-1-amine
CID 81345401
N-(cyclodecylmethyl)-2-cycloundecylcyclohexan-1-amine
CID 146209039
N'-(2-cyclohexylcyclohexyl)ethane-1,2-diamine
CID 60889120
2-cyclohexyl-N-(2-methylpropyl)cyclohexan-1-amine
CID 43222835
(2R)-1-[(2-cyclohexylcyclohexyl)amino]propan-2-ol
CID 113349396
N-but-3-enyl-2-cyclohexylcyclohexan-1-amine
CID 113465420
2-cyclohexyl-N-(2,2-dimethylpropyl)cyclohexan-1-amine
CID 63452484
4-[[(2-cyclohexylcyclohexyl)amino]methyl]phenol
CID 114331396
N-(2-cyclotridecylcycloheptyl)cyclotridecanamine
CID 156542642
2-[(2-cyclohexylcyclohexyl)amino]propane-1,3-diol
CID 65313032
3-[2-[(2-cyclohexylcyclohexyl)amino]ethylsulfanyl]propan-1-ol
CID 106309376

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine?
The IUPAC name of N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine (CID 113464984) is N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine?
The canonical SMILES for N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine is C=C(Br)CNC1CCCCC1C1CCCCC1.
What is the InChIKey of N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine?
The InChIKey is YXTBQCATXHTWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26BrN/c1-12(16)11-17-15-10-6-5-9-14(15)13-7-3-2-4-8-13/h13-15,17H,1-11H2.
What are the key properties of N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine?
N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine has a molecular weight of 300.28 g/mol, XLogP of 4.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoprop-2-enyl)-2-cyclohexylcyclohexan-1-amine is sourced from PubChem (CID 113464984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).