N,N-dimethyl-2H-pyrrole-5-carboxamide

C7H10N2O — CID 152692518

IUPACN,N-dimethyl-2H-pyrrole-5-carboxamide
SMILESCN(C)C(=O)C1=NCC=C1
InChIInChI=1S/C7H10N2O/c1-9(2)7(10)6-4-3-5-8-6/h3-4H,5H2,1-2H3
InChIKeyZPWHFLXDRRQQGK-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.09
Rot. Bonds1

About N,N-dimethyl-2H-pyrrole-5-carboxamide

N,N-dimethyl-2H-pyrrole-5-carboxamide (PubChem CID 152692518) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N,N-dimethyl-2H-pyrrole-5-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2H-pyrrole-5-carboxamide
PubChem CID152692518
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN,N-dimethyl-2H-pyrrole-5-carboxamide
SMILESCN(C)C(=O)C1=NCC=C1
InChIInChI=1S/C7H10N2O/c1-9(2)7(10)6-4-3-5-8-6/h3-4H,5H2,1-2H3
InChIKeyZPWHFLXDRRQQGK-UHFFFAOYSA-N
XLogP0.09
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2H-pyrrole-5-carboxamide?
The IUPAC name of N,N-dimethyl-2H-pyrrole-5-carboxamide (CID 152692518) is N,N-dimethyl-2H-pyrrole-5-carboxamide.
What is the SMILES notation for N,N-dimethyl-2H-pyrrole-5-carboxamide?
The canonical SMILES for N,N-dimethyl-2H-pyrrole-5-carboxamide is CN(C)C(=O)C1=NCC=C1.
What is the InChIKey of N,N-dimethyl-2H-pyrrole-5-carboxamide?
The InChIKey is ZPWHFLXDRRQQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-9(2)7(10)6-4-3-5-8-6/h3-4H,5H2,1-2H3.
What are the key properties of N,N-dimethyl-2H-pyrrole-5-carboxamide?
N,N-dimethyl-2H-pyrrole-5-carboxamide has a molecular weight of 138.17 g/mol, XLogP of 0.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2H-pyrrole-5-carboxamide is sourced from PubChem (CID 152692518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).