carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole

C9H16MtN- — CID 59085075

IUPACcarbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole
SMILESCC1=NC(C)C(C)=C1C.[CH3-].[Mt]
InChIInChI=1S/C8H13N.CH3.Mt/c1-5-6(2)8(4)9-7(5)3;;/h7H,1-4H3;1H3;/q;-1;
InChIKeyMQRSYGUTCCTUMC-UHFFFAOYSA-N
MW416.23 g/mol
LogP2.64
Rot. Bonds

About carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole

carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole (PubChem CID 59085075) has the molecular formula C9H16MtN- and a molecular weight of 416.23 g/mol. Its IUPAC name is carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole.

Molecular Properties

Compound Namecarbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole
PubChem CID59085075
Molecular FormulaC9H16MtN-
Molecular Weight416.23 g/mol
Exact Mass416.28
IUPAC Namecarbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole
SMILESCC1=NC(C)C(C)=C1C.[CH3-].[Mt]
InChIInChI=1S/C8H13N.CH3.Mt/c1-5-6(2)8(4)9-7(5)3;;/h7H,1-4H3;1H3;/q;-1;
InChIKeyMQRSYGUTCCTUMC-UHFFFAOYSA-N
XLogP2.64
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.23
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-Methyl-4-(propan-2-ylidene)-3,4-dihydro-2H-pyrrole
CID 15581274
(E)-N,3-diethyl-4-fluoropent-3-en-2-imine
CID 89207606
4-methyl-N-propan-2-ylpent-3-en-2-imine
CID 12378513
3,4,5-trimethyl-2H-pyrrole
CID 12554796
2,3,4,5-tetramethyl-2H-pyrrole
CID 18508458
1,3,4,5-tetramethyl-2H-pyrrol-1-ium
CID 21303742
4,5-dimethyl-2H-pyrrole
CID 21353924
2,3,5-trimethyl-2H-pyrrole
CID 23422226
N,3,4-trimethylpent-3-en-2-imine
CID 54299985
4-tert-butyl-3,5-dimethyl-2H-pyrrole
CID 58186510
4-butyl-3,5-dimethyl-2H-pyrrole
CID 58851243
N-ethyl-3,4-dimethylpent-3-en-2-imine
CID 59576226

Frequently Asked Questions

What is the IUPAC name of carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole?
The IUPAC name of carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole (CID 59085075) is carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole.
What is the SMILES notation for carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole?
The canonical SMILES for carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole is CC1=NC(C)C(C)=C1C.[CH3-].[Mt].
What is the InChIKey of carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole?
The InChIKey is MQRSYGUTCCTUMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N.CH3.Mt/c1-5-6(2)8(4)9-7(5)3;;/h7H,1-4H3;1H3;/q;-1;.
What are the key properties of carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole?
carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole has a molecular weight of 416.23 g/mol, XLogP of 2.64, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;meitnerium;2,3,4,5-tetramethyl-2H-pyrrole is sourced from PubChem (CID 59085075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).