N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide

C11H18N2O — CID 20604644

IUPACN,N,1,2,4,5-hexamethylpyrrole-3-carboxamide
SMILESCc1c(C(=O)N(C)C)c(C)n(C)c1C
InChIInChI=1S/C11H18N2O/c1-7-8(2)13(6)9(3)10(7)11(14)12(4)5/h1-6H3
InChIKeyOYUUMXWMBFNWET-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.65
Rot. Bonds1

About N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide

N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide (PubChem CID 20604644) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide.

Molecular Properties

Compound NameN,N,1,2,4,5-hexamethylpyrrole-3-carboxamide
PubChem CID20604644
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC NameN,N,1,2,4,5-hexamethylpyrrole-3-carboxamide
SMILESCc1c(C(=O)N(C)C)c(C)n(C)c1C
InChIInChI=1S/C11H18N2O/c1-7-8(2)13(6)9(3)10(7)11(14)12(4)5/h1-6H3
InChIKeyOYUUMXWMBFNWET-UHFFFAOYSA-N
XLogP1.65
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide?
The IUPAC name of N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide (CID 20604644) is N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide.
What is the SMILES notation for N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide?
The canonical SMILES for N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide is Cc1c(C(=O)N(C)C)c(C)n(C)c1C.
What is the InChIKey of N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide?
The InChIKey is OYUUMXWMBFNWET-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-7-8(2)13(6)9(3)10(7)11(14)12(4)5/h1-6H3.
What are the key properties of N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide?
N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide has a molecular weight of 194.28 g/mol, XLogP of 1.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide is sourced from PubChem (CID 20604644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).