N-ethyl-2,4,6-trimethylaniline;trichlorocobalt

C11H17Cl3CoN — CID 175492327

IUPACN-ethyl-2,4,6-trimethylaniline;trichlorocobalt
SMILESCCNc1c(C)cc(C)cc1C.Cl[Co](Cl)Cl
InChIInChI=1S/C11H17N.3ClH.Co/c1-5-12-11-9(3)6-8(2)7-10(11)4;;;;/h6-7,12H,5H2,1-4H3;3*1H;/q;;;;+3/p-3
InChIKeyQEHPTGUYPPVFHB-UHFFFAOYSA-K
MW328.56 g/mol
LogP5.11
Rot. Bonds2

About N-ethyl-2,4,6-trimethylaniline;trichlorocobalt

N-ethyl-2,4,6-trimethylaniline;trichlorocobalt (PubChem CID 175492327) has the molecular formula C11H17Cl3CoN and a molecular weight of 328.56 g/mol. Its IUPAC name is N-ethyl-2,4,6-trimethylaniline;trichlorocobalt.

Molecular Properties

Compound NameN-ethyl-2,4,6-trimethylaniline;trichlorocobalt
PubChem CID175492327
Molecular FormulaC11H17Cl3CoN
Molecular Weight328.56 g/mol
Exact Mass326.98
IUPAC NameN-ethyl-2,4,6-trimethylaniline;trichlorocobalt
SMILESCCNc1c(C)cc(C)cc1C.Cl[Co](Cl)Cl
InChIInChI=1S/C11H17N.3ClH.Co/c1-5-12-11-9(3)6-8(2)7-10(11)4;;;;/h6-7,12H,5H2,1-4H3;3*1H;/q;;;;+3/p-3
InChIKeyQEHPTGUYPPVFHB-UHFFFAOYSA-K
XLogP5.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.56
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-2,6-dimethyl-4-propylaniline;formonitrile
CID 161054115
N-ethyl-4-methoxy-2,6-dimethylaniline
CID 23348858
N-ethyl-2-(2,4,6-trimethylanilino)acetamide
CID 54812059
N'-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 20780242
3-(2,4,6-trimethylanilino)propanethioamide
CID 82080350
N-(3,3-dimethylbutyl)-2,4,6-trimethylaniline
CID 63448276
manganese;N'-methyl-N'-[2-(2,4,6-trimethylanilino)ethyl]-N-(2,4,6-trimethylphenyl)ethane-1,2-diamine
CID 66808827
1-N,2-N-bis(2,4,6-trimethylphenyl)propane-1,2-diamine
CID 20512413
2,4,6-trimethyl-N-(3-methylbut-2-enyl)aniline
CID 58339600
(2,4,6-trimethylphenyl)thiourea
CID 2731118
2,4,6-trimethyl-N-(2-phenylpropyl)aniline
CID 55192336
N-[(3-chloro-4-methylphenyl)methyl]-2,4,6-trimethylaniline
CID 106816595

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4,6-trimethylaniline;trichlorocobalt?
The IUPAC name of N-ethyl-2,4,6-trimethylaniline;trichlorocobalt (CID 175492327) is N-ethyl-2,4,6-trimethylaniline;trichlorocobalt.
What is the SMILES notation for N-ethyl-2,4,6-trimethylaniline;trichlorocobalt?
The canonical SMILES for N-ethyl-2,4,6-trimethylaniline;trichlorocobalt is CCNc1c(C)cc(C)cc1C.Cl[Co](Cl)Cl.
What is the InChIKey of N-ethyl-2,4,6-trimethylaniline;trichlorocobalt?
The InChIKey is QEHPTGUYPPVFHB-UHFFFAOYSA-K. The full InChI is InChI=1S/C11H17N.3ClH.Co/c1-5-12-11-9(3)6-8(2)7-10(11)4;;;;/h6-7,12H,5H2,1-4H3;3*1H;/q;;;;+3/p-3.
What are the key properties of N-ethyl-2,4,6-trimethylaniline;trichlorocobalt?
N-ethyl-2,4,6-trimethylaniline;trichlorocobalt has a molecular weight of 328.56 g/mol, XLogP of 5.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4,6-trimethylaniline;trichlorocobalt is sourced from PubChem (CID 175492327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).