4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide

C13H16N4O — CID 43643038

IUPAC4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide
SMILESCCn1cc(N)cc1C(=O)Nc1ncccc1C
InChIInChI=1S/C13H16N4O/c1-3-17-8-10(14)7-11(17)13(18)16-12-9(2)5-4-6-15-12/h4-8H,3,14H2,1-2H3,(H,15,16,18)
InChIKeyDBOGXCKJPPGLQU-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.05
Rot. Bonds3

About 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide

4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide (PubChem CID 43643038) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide
PubChem CID43643038
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide
SMILESCCn1cc(N)cc1C(=O)Nc1ncccc1C
InChIInChI=1S/C13H16N4O/c1-3-17-8-10(14)7-11(17)13(18)16-12-9(2)5-4-6-15-12/h4-8H,3,14H2,1-2H3,(H,15,16,18)
InChIKeyDBOGXCKJPPGLQU-UHFFFAOYSA-N
XLogP2.05
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-1-ethyl-N-(4-methylphenyl)pyrrole-2-carboxamide
CID 43642219
4-amino-N-(2-chloropyrimidin-4-yl)-1-ethylpyrrole-2-carboxamide
CID 116794605
4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrazole-3-carboxamide
CID 65359038
4-amino-N-(5-bromo-2-methylphenyl)-1-ethylpyrrole-2-carboxamide
CID 43805818
4-amino-N-(5-chloro-2-pyridinyl)-1-ethylpyrrole-2-carboxamide
CID 43643180
1-ethyl-6-fluoro-N-(3-methyl-2-pyridinyl)-4-oxoquinoline-3-carboxamide
CID 39851051
4-amino-1-ethyl-N-(3-iodophenyl)pyrrole-2-carboxamide
CID 43643246
4-amino-N-(3-ethoxyphenyl)-1-ethylpyrrole-2-carboxamide
CID 61103176
4-amino-N-(2-methyl-4-pyridinyl)-1-propylpyrrole-2-carboxamide
CID 79234677
4-amino-N-(2-chloro-4-methyl-3-pyridinyl)-1-propylpyrrole-2-carboxamide
CID 65489271
4-amino-1-ethyl-N-[4-(trifluoromethyl)phenyl]pyrrole-2-carboxamide
CID 43642862
4-amino-1-ethyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide
CID 61128385

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide (CID 43643038) is 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide is CCn1cc(N)cc1C(=O)Nc1ncccc1C.
What is the InChIKey of 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide?
The InChIKey is DBOGXCKJPPGLQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c1-3-17-8-10(14)7-11(17)13(18)16-12-9(2)5-4-6-15-12/h4-8H,3,14H2,1-2H3,(H,15,16,18).
What are the key properties of 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide?
4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide has a molecular weight of 244.30 g/mol, XLogP of 2.05, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-(3-methyl-2-pyridinyl)pyrrole-2-carboxamide is sourced from PubChem (CID 43643038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).