N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide

C14H14N4O2 — CID 167655429

IUPACN-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide
SMILESCCNC(=O)n1ccc(-c2ccnc3c2CC(=O)N3)c1
InChIInChI=1S/C14H14N4O2/c1-2-15-14(20)18-6-4-9(8-18)10-3-5-16-13-11(10)7-12(19)17-13/h3-6,8H,2,7H2,1H3,(H,15,20)(H,16,17,19)
InChIKeyRENJKOVGTXJRRS-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.62
Rot. Bonds2

About N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide

N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide (PubChem CID 167655429) has the molecular formula C14H14N4O2 and a molecular weight of 270.29 g/mol. Its IUPAC name is N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide
PubChem CID167655429
Molecular FormulaC14H14N4O2
Molecular Weight270.29 g/mol
Exact Mass270.11
IUPAC NameN-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide
SMILESCCNC(=O)n1ccc(-c2ccnc3c2CC(=O)N3)c1
InChIInChI=1S/C14H14N4O2/c1-2-15-14(20)18-6-4-9(8-18)10-3-5-16-13-11(10)7-12(19)17-13/h3-6,8H,2,7H2,1H3,(H,15,20)(H,16,17,19)
InChIKeyRENJKOVGTXJRRS-UHFFFAOYSA-N
XLogP1.62
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 10999049
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CID 838086
N-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-ylpyrrol-3-yl)methyl]propanamide
CID 1484953
2-phenyl-N-(2-pyridinyl)butanamide
CID 2852795
1-[(4-methylphenyl)methyl]-N-(3-methyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 24686893
5-keto-1-(4-methylbenzyl)-N-(5-methyl-2-pyridyl)pyrrolidine-3-carboxamide
CID 24980408
3-(1-Methyl-1H-indol-3-ylmethylene)-1,3-dihydro-pyrrolo[2,3-b]pyridin-2-one
CID 9943464
3,6-Dimethyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
CID 10014479
6-Methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
CID 10398747
(3Z)-3-[[4-(dimethylamino)phenyl]methylidene]-1H-pyrrolo[2,3-b]pyridin-2-one
CID 66556402
(6S)-2-amino-6-methyl-3-[[2-[(4R)-2-oxo-4-phenylpyrrolidin-1-yl]-4-pyridinyl]methyl]-6-propan-2-yl-5H-pyrimidin-4-one
CID 89818383

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide?
The IUPAC name of N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide (CID 167655429) is N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide.
What is the SMILES notation for N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide?
The canonical SMILES for N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide is CCNC(=O)n1ccc(-c2ccnc3c2CC(=O)N3)c1.
What is the InChIKey of N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide?
The InChIKey is RENJKOVGTXJRRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O2/c1-2-15-14(20)18-6-4-9(8-18)10-3-5-16-13-11(10)7-12(19)17-13/h3-6,8H,2,7H2,1H3,(H,15,20)(H,16,17,19).
What are the key properties of N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide?
N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-oxo-1,3-dihydropyrrolo[2,3-b]pyridin-4-yl)pyrrole-1-carboxamide is sourced from PubChem (CID 167655429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).