ethane;2,3,4,5-tetramethyl-1H-pyrrole

C10H19N — CID 91515820

IUPACethane;2,3,4,5-tetramethyl-1H-pyrrole
SMILESCC.Cc1[nH]c(C)c(C)c1C
InChIInChI=1S/C8H13N.C2H6/c1-5-6(2)8(4)9-7(5)3;1-2/h9H,1-4H3;1-2H3
InChIKeyYUDZMISYMJRUEY-UHFFFAOYSA-N
MW153.27 g/mol
LogP3.27
Rot. Bonds

About ethane;2,3,4,5-tetramethyl-1H-pyrrole

ethane;2,3,4,5-tetramethyl-1H-pyrrole (PubChem CID 91515820) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is ethane;2,3,4,5-tetramethyl-1H-pyrrole.

Molecular Properties

Compound Nameethane;2,3,4,5-tetramethyl-1H-pyrrole
PubChem CID91515820
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Nameethane;2,3,4,5-tetramethyl-1H-pyrrole
SMILESCC.Cc1[nH]c(C)c(C)c1C
InChIInChI=1S/C8H13N.C2H6/c1-5-6(2)8(4)9-7(5)3;1-2/h9H,1-4H3;1-2H3
InChIKeyYUDZMISYMJRUEY-UHFFFAOYSA-N
XLogP3.27
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

3-chloro-2,4,5-trimethyl-1H-pyrrole
CID 59864853
ethane;2,3,6-trimethyl-5-nitro-1H-pyridin-4-one
CID 144663698
2-ethyl-3,4,5-trimethyl-1H-pyrrole
CID 578993
2-tert-butyl-3,4,5-trimethyl-1H-pyrrole
CID 18740631
bis(3,4,5-trimethyl-1H-pyrrol-2-yl)methanethione
CID 134892863
4-bromo-3,5,6-trimethyl-1H-pyridin-2-one
CID 14203602
ethane;1,2,3,4,5,6-hexamethylbenzene
CID 144963527
3,4-difluoro-2,5-dimethyl-1H-pyrrole
CID 89253678
1,3,5,6-tetramethyl-2H-isoindole-4,7-dione
CID 10608220
2,3,4-trimethyl-5-penta-1,3-dienyl-1H-pyrrole
CID 151837889
3,4-ditert-butyl-5,6-dimethyl-1H-pyridin-2-one
CID 171744974
3-bromo-4,5-dimethyl-1H-pyrrole-2-carboxylic acid
CID 83814937

Frequently Asked Questions

What is the IUPAC name of ethane;2,3,4,5-tetramethyl-1H-pyrrole?
The IUPAC name of ethane;2,3,4,5-tetramethyl-1H-pyrrole (CID 91515820) is ethane;2,3,4,5-tetramethyl-1H-pyrrole.
What is the SMILES notation for ethane;2,3,4,5-tetramethyl-1H-pyrrole?
The canonical SMILES for ethane;2,3,4,5-tetramethyl-1H-pyrrole is CC.Cc1[nH]c(C)c(C)c1C.
What is the InChIKey of ethane;2,3,4,5-tetramethyl-1H-pyrrole?
The InChIKey is YUDZMISYMJRUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N.C2H6/c1-5-6(2)8(4)9-7(5)3;1-2/h9H,1-4H3;1-2H3.
What are the key properties of ethane;2,3,4,5-tetramethyl-1H-pyrrole?
ethane;2,3,4,5-tetramethyl-1H-pyrrole has a molecular weight of 153.27 g/mol, XLogP of 3.27, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,3,4,5-tetramethyl-1H-pyrrole is sourced from PubChem (CID 91515820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).