N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide

C10H11BrN2O — CID 103819502

IUPACN-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cccnc1Br
InChIInChI=1S/C10H11BrN2O/c1-6-5-7(6)10(14)13-8-3-2-4-12-9(8)11/h2-4,6-7H,5H2,1H3,(H,13,14)
InChIKeyWUUCYWWLZLINQK-UHFFFAOYSA-N
MW255.12 g/mol
LogP2.44
Rot. Bonds2

About N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide

N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide (PubChem CID 103819502) has the molecular formula C10H11BrN2O and a molecular weight of 255.12 g/mol. Its IUPAC name is N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide
PubChem CID103819502
Molecular FormulaC10H11BrN2O
Molecular Weight255.12 g/mol
Exact Mass254.01
IUPAC NameN-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide
SMILESCC1CC1C(=O)Nc1cccnc1Br
InChIInChI=1S/C10H11BrN2O/c1-6-5-7(6)10(14)13-8-3-2-4-12-9(8)11/h2-4,6-7H,5H2,1H3,(H,13,14)
InChIKeyWUUCYWWLZLINQK-UHFFFAOYSA-N
XLogP2.44
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.12
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2-bromo-3-pyridinyl)-3-methyloxolane-2-carboxamide
CID 103819174
N-(2-bromo-3-pyridinyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 103841304
N-(2-bromo-3-pyridinyl)oxane-4-carboxamide
CID 103819148
N-(2-bromo-3-pyridinyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103943345
3-[(2-methylcyclopentanecarbonyl)amino]pyridine-2-carboxylic acid
CID 107175917
N-(3-bromoquinolin-8-yl)-2-methylcyclopropane-1-carboxamide
CID 116784759
N-[2-(bromomethyl)phenyl]-2-methylcyclopropane-1-carboxamide
CID 114309765
N-(2-bromo-3-pyridinyl)oxane-2-carboxamide
CID 103822374
trans-(1R,2R)-2-methyl-N-pyridin-3-ylcyclopropane-1-carboxamide
CID 131159605
N-(2-bromo-3-pyridinyl)-2,3-dihydro-1-benzothiophene-3-carboxamide
CID 113268388
2-methyl-N-(2-methyl-4-pyrimidin-2-yloxyphenyl)cyclopropane-1-carboxamide
CID 48666589
N-(5-bromo-2-methylphenyl)-2-methylcyclopropane-1-carboxamide
CID 43806366

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide?
The IUPAC name of N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide (CID 103819502) is N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide?
The canonical SMILES for N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide is CC1CC1C(=O)Nc1cccnc1Br.
What is the InChIKey of N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide?
The InChIKey is WUUCYWWLZLINQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN2O/c1-6-5-7(6)10(14)13-8-3-2-4-12-9(8)11/h2-4,6-7H,5H2,1H3,(H,13,14).
What are the key properties of N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide?
N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide has a molecular weight of 255.12 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-pyridinyl)-2-methylcyclopropane-1-carboxamide is sourced from PubChem (CID 103819502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).