3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide

C11H18N2O — CID 21438473

IUPAC3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide
SMILESCc1c(C)c(C)n(CCC(N)=O)c1C
InChIInChI=1S/C11H18N2O/c1-7-8(2)10(4)13(9(7)3)6-5-11(12)14/h5-6H2,1-4H3,(H2,12,14)
InChIKeyMEOFOPLWEXCCID-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.60
Rot. Bonds3

About 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide

3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide (PubChem CID 21438473) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide.

Molecular Properties

Compound Name3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide
PubChem CID21438473
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide
SMILESCc1c(C)c(C)n(CCC(N)=O)c1C
InChIInChI=1S/C11H18N2O/c1-7-8(2)10(4)13(9(7)3)6-5-11(12)14/h5-6H2,1-4H3,(H2,12,14)
InChIKeyMEOFOPLWEXCCID-UHFFFAOYSA-N
XLogP1.60
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-((4-((dimethylamino)methyl)-2,5-dimethyl-1H-pyrrol-3-yl)methyl)-N,N-dimethylamine
CID 229022
1,2,3,4,5-pentamethyl-1H-pyrrole
CID 69847
2-(2,3,4,5-Tetramethyl-1H-pyrrol-1-yl)acetamide
CID 21438472
N-[3-(diethylamino)propyl]-2,4,5-trimethyl-1H-pyrrole-3-carboxamide
CID 14444312
3-(2,5-Dimethyl-1H-pyrrol-1-yl)propanamide
CID 43553922
3,4-Diethyl-1,2,5-trimethylpyrrole
CID 15711936
1-(Diethylamino)-6-ethyl-5,7-dimethyl-3h-pyrrolizin-3-one
CID 258389
2,3,4,5-Tetramethyl-1-propan-2-ylpyrrole
CID 13997858
N-[2-(3,4-dicyano-2,5-dimethylpyrrol-1-yl)ethyl]acetamide
CID 14536748
1-Ethyl-2,3,4,5-tetramethylpyrrole
CID 18683533
N-methyl-2-(2,3,4,5-tetramethylpyrrol-1-yl)acetamide
CID 18715520
N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide
CID 20604644

Frequently Asked Questions

What is the IUPAC name of 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide?
The IUPAC name of 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide (CID 21438473) is 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide.
What is the SMILES notation for 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide?
The canonical SMILES for 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide is Cc1c(C)c(C)n(CCC(N)=O)c1C.
What is the InChIKey of 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide?
The InChIKey is MEOFOPLWEXCCID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-7-8(2)10(4)13(9(7)3)6-5-11(12)14/h5-6H2,1-4H3,(H2,12,14).
What are the key properties of 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide?
3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide has a molecular weight of 194.28 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3,4,5-tetramethylpyrrol-1-yl)propanamide is sourced from PubChem (CID 21438473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).