N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt

C14H23Cl3CoN — CID 175492359

IUPACN-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt
SMILESCCNc1c(C(C)C)cccc1C(C)C.Cl[Co](Cl)Cl
InChIInChI=1S/C14H23N.3ClH.Co/c1-6-15-14-12(10(2)3)8-7-9-13(14)11(4)5;;;;/h7-11,15H,6H2,1-5H3;3*1H;/q;;;;+3/p-3
InChIKeyAAEVZMYTXCQJCZ-UHFFFAOYSA-K
MW370.64 g/mol
LogP6.43
Rot. Bonds4

About N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt

N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt (PubChem CID 175492359) has the molecular formula C14H23Cl3CoN and a molecular weight of 370.64 g/mol. Its IUPAC name is N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt.

Molecular Properties

Compound NameN-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt
PubChem CID175492359
Molecular FormulaC14H23Cl3CoN
Molecular Weight370.64 g/mol
Exact Mass369.02
IUPAC NameN-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt
SMILESCCNc1c(C(C)C)cccc1C(C)C.Cl[Co](Cl)Cl
InChIInChI=1S/C14H23N.3ClH.Co/c1-6-15-14-12(10(2)3)8-7-9-13(14)11(4)5;;;;/h7-11,15H,6H2,1-5H3;3*1H;/q;;;;+3/p-3
InChIKeyAAEVZMYTXCQJCZ-UHFFFAOYSA-K
XLogP6.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.64
LogP ≤ 56.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-[2-[2,6-di(propan-2-yl)anilino]ethoxy]ethyl]-2,6-di(propan-2-yl)aniline
CID 86189291
3-[2,6-di(propan-2-yl)anilino]propanenitrile
CID 82041201
N-pent-3-enyl-2,6-di(propan-2-yl)aniline
CID 175052075
2-ethyl-N-methyl-6-propan-2-ylaniline
CID 131620902
N-(1,3,4-oxadiazol-2-ylmethyl)-2,6-di(propan-2-yl)aniline
CID 23462311
2-chloro-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 2363774
N-butan-2-yl-3-[2,6-di(propan-2-yl)anilino]propanamide
CID 109013041
N-benzhydryl-2,6-di(propan-2-yl)aniline
CID 100979408
N-[bromo-[2,6-di(propan-2-yl)anilino]boranyl]-2,6-di(propan-2-yl)aniline
CID 139128549
N-(2-methylphosphanylphenyl)-2,6-di(propan-2-yl)aniline
CID 58961695
N-[2,6-di(propan-2-yl)phenyl]-N'-propan-2-ylmethanimidamide
CID 122212569
1-N-[2-[2,6-di(propan-2-yl)anilino]propyl]-2-N-[2,6-di(propan-2-yl)phenyl]-1-N-methylpropane-1,2-diamine
CID 18441404

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt?
The IUPAC name of N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt (CID 175492359) is N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt.
What is the SMILES notation for N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt?
The canonical SMILES for N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt is CCNc1c(C(C)C)cccc1C(C)C.Cl[Co](Cl)Cl.
What is the InChIKey of N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt?
The InChIKey is AAEVZMYTXCQJCZ-UHFFFAOYSA-K. The full InChI is InChI=1S/C14H23N.3ClH.Co/c1-6-15-14-12(10(2)3)8-7-9-13(14)11(4)5;;;;/h7-11,15H,6H2,1-5H3;3*1H;/q;;;;+3/p-3.
What are the key properties of N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt?
N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt has a molecular weight of 370.64 g/mol, XLogP of 6.43, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,6-di(propan-2-yl)aniline;trichlorocobalt is sourced from PubChem (CID 175492359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).