2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium

C10H14NY- — CID 59882702

IUPAC2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium
SMILESCc1[c-]c(N)c(C)c(C)c1C.[Y]
InChIInChI=1S/C10H14N.Y/c1-6-5-10(11)9(4)8(3)7(6)2;/h11H2,1-4H3;/q-1;
InChIKeyRDPZHVGNYOPRTO-UHFFFAOYSA-N
MW237.13 g/mol
LogP2.30
Rot. Bonds

About 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium

2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium (PubChem CID 59882702) has the molecular formula C10H14NY- and a molecular weight of 237.13 g/mol. Its IUPAC name is 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium.

Molecular Properties

Compound Name2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium
PubChem CID59882702
Molecular FormulaC10H14NY-
Molecular Weight237.13 g/mol
Exact Mass237.02
IUPAC Name2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium
SMILESCc1[c-]c(N)c(C)c(C)c1C.[Y]
InChIInChI=1S/C10H14N.Y/c1-6-5-10(11)9(4)8(3)7(6)2;/h11H2,1-4H3;/q-1;
InChIKeyRDPZHVGNYOPRTO-UHFFFAOYSA-N
XLogP2.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.13
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium?
The IUPAC name of 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium (CID 59882702) is 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium.
What is the SMILES notation for 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium?
The canonical SMILES for 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium is Cc1[c-]c(N)c(C)c(C)c1C.[Y].
What is the InChIKey of 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium?
The InChIKey is RDPZHVGNYOPRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N.Y/c1-6-5-10(11)9(4)8(3)7(6)2;/h11H2,1-4H3;/q-1;.
What are the key properties of 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium?
2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium has a molecular weight of 237.13 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethylbenzene-6-id-1-amine;yttrium is sourced from PubChem (CID 59882702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).