2,3,5-trimethyl-1H-indole;vanadium

C11H13NV — CID 159816698

IUPAC2,3,5-trimethyl-1H-indole;vanadium
SMILESCc1ccc2[nH]c(C)c(C)c2c1.[V]
InChIInChI=1S/C11H13N.V/c1-7-4-5-11-10(6-7)8(2)9(3)12-11;/h4-6,12H,1-3H3;
InChIKeyNLRYNZDSVUFEKU-UHFFFAOYSA-N
MW210.18 g/mol
LogP3.09
Rot. Bonds

About 2,3,5-trimethyl-1H-indole;vanadium

2,3,5-trimethyl-1H-indole;vanadium (PubChem CID 159816698) has the molecular formula C11H13NV and a molecular weight of 210.18 g/mol. Its IUPAC name is 2,3,5-trimethyl-1H-indole;vanadium.

Molecular Properties

Compound Name2,3,5-trimethyl-1H-indole;vanadium
PubChem CID159816698
Molecular FormulaC11H13NV
Molecular Weight210.18 g/mol
Exact Mass210.05
IUPAC Name2,3,5-trimethyl-1H-indole;vanadium
SMILESCc1ccc2[nH]c(C)c(C)c2c1.[V]
InChIInChI=1S/C11H13N.V/c1-7-4-5-11-10(6-7)8(2)9(3)12-11;/h4-6,12H,1-3H3;
InChIKeyNLRYNZDSVUFEKU-UHFFFAOYSA-N
XLogP3.09
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

ethane;prop-1-ene;2,3,5-trimethyl-1H-indole
CID 143420454
3,6-dimethyl-9H-carbazole
CID 144942624
2-ethyl-3,5-dimethyl-1H-indole
CID 1209049
2,3-dimethyl-1H-indole-5-carbonitrile
CID 15483079
2,7-dimethyl-10H-acridin-9-one
CID 13293445
2-(2,3-dimethyl-1H-indol-5-yl)ethanethiol
CID 116996346
3,5-dimethyl-2-phenyl-1H-indole;ethane
CID 91536614
3,4,6-trimethyl-9H-carbazole
CID 610656
O-[(2,3-dimethyl-1H-indol-5-yl)methyl]hydroxylamine
CID 117281978
2,8-dimethyl-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
CID 24764365
methyl 2,3-dimethyl-1H-indole-5-carboxylate
CID 11344717
3-(3,5-dimethyl-1H-indol-2-yl)propan-1-ol
CID 170857441

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethyl-1H-indole;vanadium?
The IUPAC name of 2,3,5-trimethyl-1H-indole;vanadium (CID 159816698) is 2,3,5-trimethyl-1H-indole;vanadium.
What is the SMILES notation for 2,3,5-trimethyl-1H-indole;vanadium?
The canonical SMILES for 2,3,5-trimethyl-1H-indole;vanadium is Cc1ccc2[nH]c(C)c(C)c2c1.[V].
What is the InChIKey of 2,3,5-trimethyl-1H-indole;vanadium?
The InChIKey is NLRYNZDSVUFEKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N.V/c1-7-4-5-11-10(6-7)8(2)9(3)12-11;/h4-6,12H,1-3H3;.
What are the key properties of 2,3,5-trimethyl-1H-indole;vanadium?
2,3,5-trimethyl-1H-indole;vanadium has a molecular weight of 210.18 g/mol, XLogP of 3.09, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethyl-1H-indole;vanadium is sourced from PubChem (CID 159816698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).