5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide

C11H11BrN2O — CID 160754321

IUPAC5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide
SMILESCN(C)C(=O)c1cnc2c(c1)C(Br)=CC2
InChIInChI=1S/C11H11BrN2O/c1-14(2)11(15)7-5-8-9(12)3-4-10(8)13-6-7/h3,5-6H,4H2,1-2H3
InChIKeyRXFOQPILUXBVCJ-UHFFFAOYSA-N
MW267.13 g/mol
LogP2.08
Rot. Bonds1

About 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide

5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide (PubChem CID 160754321) has the molecular formula C11H11BrN2O and a molecular weight of 267.13 g/mol. Its IUPAC name is 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide
PubChem CID160754321
Molecular FormulaC11H11BrN2O
Molecular Weight267.13 g/mol
Exact Mass266.01
IUPAC Name5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide
SMILESCN(C)C(=O)c1cnc2c(c1)C(Br)=CC2
InChIInChI=1S/C11H11BrN2O/c1-14(2)11(15)7-5-8-9(12)3-4-10(8)13-6-7/h3,5-6H,4H2,1-2H3
InChIKeyRXFOQPILUXBVCJ-UHFFFAOYSA-N
XLogP2.08
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N,5,6-tetramethylpyridine-3-carboxamide
CID 178150926
N,N,6,8-tetramethylquinoline-3-carboxamide
CID 10561334
6-amino-N,N,5-trimethylpyridine-3-carboxamide;ethane
CID 178150598
methyl 5-iodo-7H-cyclopenta[b]pyridine-3-carboxylate
CID 146805673
ethane;5-methoxy-N,N,6-trimethylpyridine-3-carboxamide
CID 145223857
5-chloro-N,N-dimethyl-6-(methylamino)pyridine-3-carboxamide
CID 62170738
N,N-dimethyl-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-6-carboxamide
CID 47215053
N,N-dimethyl-5-propan-2-ylpyridine-3-carboxamide
CID 59135268
5-bromo-6-chloro-N-cyclopropyl-N-methylpyridine-3-carboxamide
CID 130550487
6-chloro-N,N-dimethylpyridine-3-carboxamide;6-chloropyridine-3-carbonyl chloride
CID 159595421
5-ethynyl-N,N-dimethylpyridine-3-carboxamide
CID 130118726
6-(2,2-dimethylhydrazinyl)-N,N-dimethylpyridine-3-carboxamide
CID 83025620

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide (CID 160754321) is 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide is CN(C)C(=O)c1cnc2c(c1)C(Br)=CC2.
What is the InChIKey of 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide?
The InChIKey is RXFOQPILUXBVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2O/c1-14(2)11(15)7-5-8-9(12)3-4-10(8)13-6-7/h3,5-6H,4H2,1-2H3.
What are the key properties of 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide?
5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide has a molecular weight of 267.13 g/mol, XLogP of 2.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N,N-dimethyl-7H-cyclopenta[b]pyridine-3-carboxamide is sourced from PubChem (CID 160754321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).