bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt

C20H28CoN3- — CID 66809098

IUPACbis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt
SMILESCc1cccc(C)c1C(N)C[N-]CC(N)c1c(C)cccc1C.[Co]
InChIInChI=1S/C20H28N3.Co/c1-13-7-5-8-14(2)19(13)17(21)11-23-12-18(22)20-15(3)9-6-10-16(20)4;/h5-10,17-18H,11-12,21-22H2,1-4H3;/q-1;
InChIKeyVIUBAIMKYYDKNZ-UHFFFAOYSA-N
MW369.40 g/mol
LogP3.99
Rot. Bonds6

About bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt

bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt (PubChem CID 66809098) has the molecular formula C20H28CoN3- and a molecular weight of 369.40 g/mol. Its IUPAC name is bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt.

Molecular Properties

Compound Namebis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt
PubChem CID66809098
Molecular FormulaC20H28CoN3-
Molecular Weight369.40 g/mol
Exact Mass369.16
IUPAC Namebis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt
SMILESCc1cccc(C)c1C(N)C[N-]CC(N)c1c(C)cccc1C.[Co]
InChIInChI=1S/C20H28N3.Co/c1-13-7-5-8-14(2)19(13)17(21)11-23-12-18(22)20-15(3)9-6-10-16(20)4;/h5-10,17-18H,11-12,21-22H2,1-4H3;/q-1;
InChIKeyVIUBAIMKYYDKNZ-UHFFFAOYSA-N
XLogP3.99
TPSA66.14 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;dichlororuthenium
CID 87161798
1-(2,6-dimethylphenyl)propan-1-amine
CID 55282920
1-(2,6-dimethylphenyl)-2-fluoroethanamine
CID 130061517
1-(2,6-dimethylphenyl)butan-1-amine
CID 55283008
bis[2-amino-2-[2,6-di(propan-2-yl)phenyl]ethyl]azanide;copper(1+)
CID 66809160
(3S)-3-amino-3-(2,6-dimethylphenyl)propan-1-ol
CID 130664971
bis[2-amino-2-(2,4,6-trimethylphenyl)ethyl]azanide;dichloromanganese
CID 66808819
(1R)-1-(2,6-dimethylphenyl)-3-fluoropropan-1-amine;hydrochloride
CID 171204326
(1S)-1-(2,6-dimethylphenyl)pentane-1,5-diamine
CID 171223884
3-amino-3-(2,6-dimethylphenyl)propanoic acid
CID 53441887
(3S)-3-amino-3-(2,6-dimethylphenyl)propanoic acid
CID 79003053
2-[(1R)-1-aminopropyl]-3-methylphenol
CID 130648593

Frequently Asked Questions

What is the IUPAC name of bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt?
The IUPAC name of bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt (CID 66809098) is bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt.
What is the SMILES notation for bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt?
The canonical SMILES for bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt is Cc1cccc(C)c1C(N)C[N-]CC(N)c1c(C)cccc1C.[Co].
What is the InChIKey of bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt?
The InChIKey is VIUBAIMKYYDKNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N3.Co/c1-13-7-5-8-14(2)19(13)17(21)11-23-12-18(22)20-15(3)9-6-10-16(20)4;/h5-10,17-18H,11-12,21-22H2,1-4H3;/q-1;.
What are the key properties of bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt?
bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt has a molecular weight of 369.40 g/mol, XLogP of 3.99, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-amino-2-(2,6-dimethylphenyl)ethyl]azanide;cobalt is sourced from PubChem (CID 66809098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).