N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide

C11H13BrN2O2 — CID 102820636

IUPACN-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide
SMILESCC1(C(=O)Nc2cc(Br)ccn2)CCCO1
InChIInChI=1S/C11H13BrN2O2/c1-11(4-2-6-16-11)10(15)14-9-7-8(12)3-5-13-9/h3,5,7H,2,4,6H2,1H3,(H,13,14,15)
InChIKeyFESARHLXVFBTOV-UHFFFAOYSA-N
MW285.14 g/mol
LogP2.35
Rot. Bonds2

About N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide

N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide (PubChem CID 102820636) has the molecular formula C11H13BrN2O2 and a molecular weight of 285.14 g/mol. Its IUPAC name is N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide
PubChem CID102820636
Molecular FormulaC11H13BrN2O2
Molecular Weight285.14 g/mol
Exact Mass284.02
IUPAC NameN-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide
SMILESCC1(C(=O)Nc2cc(Br)ccn2)CCCO1
InChIInChI=1S/C11H13BrN2O2/c1-11(4-2-6-16-11)10(15)14-9-7-8(12)3-5-13-9/h3,5,7H,2,4,6H2,1H3,(H,13,14,15)
InChIKeyFESARHLXVFBTOV-UHFFFAOYSA-N
XLogP2.35
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.14
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(6-bromonaphthalen-2-yl)-2-methyloxolane-2-carboxamide
CID 81003405
N-(4-bromo-2-ethylphenyl)-2-methyloxolane-2-carboxamide
CID 81037060
(2R)-N-[5-(4-bromophenyl)-1-methylimidazol-2-yl]-2-methyloxolane-2-carboxamide
CID 51492899
N-(4-bromo-2-pyridinyl)piperidine-1-carboxamide
CID 102820657
N-(4-bromo-2-pyridinyl)cyclopentanecarboxamide
CID 102674366
N-(6-chloro-5-methyl-3-pyridinyl)-2-methyloxolane-2-carboxamide
CID 103747057
4-bromo-N-(4-bromo-2-pyridinyl)butanamide;ethane
CID 177218315
N-(4-bromo-2-pyridinyl)-5-methylpyrazine-2-carboxamide
CID 102674370
N-(3,5-dichloro-4-hydroxyphenyl)-2-methyloxolane-2-carboxamide
CID 82884665
N-[2-(bromomethyl)phenyl]-2-methyloxolane-2-carboxamide
CID 114309752
1-(4-bromo-2-pyridinyl)-3-cyclopentylurea
CID 108902777
N-(2-tert-butyl-1,2,4-triazol-3-yl)-2-methyloxolane-2-carboxamide
CID 136541078

Frequently Asked Questions

What is the IUPAC name of N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide?
The IUPAC name of N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide (CID 102820636) is N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide.
What is the SMILES notation for N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide?
The canonical SMILES for N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide is CC1(C(=O)Nc2cc(Br)ccn2)CCCO1.
What is the InChIKey of N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide?
The InChIKey is FESARHLXVFBTOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN2O2/c1-11(4-2-6-16-11)10(15)14-9-7-8(12)3-5-13-9/h3,5,7H,2,4,6H2,1H3,(H,13,14,15).
What are the key properties of N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide?
N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide has a molecular weight of 285.14 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromo-2-pyridinyl)-2-methyloxolane-2-carboxamide is sourced from PubChem (CID 102820636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).