N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide

C10H11ClN2O2 — CID 4166852

IUPACN-(2-chloro-3-pyridinyl)oxolane-2-carboxamide
SMILESO=C(Nc1cccnc1Cl)C1CCCO1
InChIInChI=1S/C10H11ClN2O2/c11-9-7(3-1-5-12-9)13-10(14)8-4-2-6-15-8/h1,3,5,8H,2,4,6H2,(H,13,14)
InChIKeyLYXSOXQHIFFCFI-UHFFFAOYSA-N
MW226.66 g/mol
LogP1.85
Rot. Bonds2

About N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide

N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide (PubChem CID 4166852) has the molecular formula C10H11ClN2O2 and a molecular weight of 226.66 g/mol. Its IUPAC name is N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-3-pyridinyl)oxolane-2-carboxamide
PubChem CID4166852
Molecular FormulaC10H11ClN2O2
Molecular Weight226.66 g/mol
Exact Mass226.05
IUPAC NameN-(2-chloro-3-pyridinyl)oxolane-2-carboxamide
SMILESO=C(Nc1cccnc1Cl)C1CCCO1
InChIInChI=1S/C10H11ClN2O2/c11-9-7(3-1-5-12-9)13-10(14)8-4-2-6-15-8/h1,3,5,8H,2,4,6H2,(H,13,14)
InChIKeyLYXSOXQHIFFCFI-UHFFFAOYSA-N
XLogP1.85
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.66
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-bromo-3-pyridinyl)oxane-2-carboxamide
CID 103822374
N-quinolin-8-yloxane-2-carboxamide
CID 110863491
N-(2,3-dichlorophenyl)oxolane-2-carboxamide
CID 3155144
N-(2-chloro-5-methyl-3-pyridinyl)oxolane-2-carboxamide
CID 102979589
N-(3-chloro-2-pyrazol-1-ylphenyl)oxolane-2-carboxamide
CID 87007046
(2S)-N-(2-bromo-3-chlorophenyl)oxolane-2-carboxamide
CID 103479904
(2R)-N-(5-bromoquinolin-8-yl)oxolane-2-carboxamide
CID 35287150
N-(1-methylisoquinolin-5-yl)oxolane-2-carboxamide
CID 154789089
N-[3-(3-chloro-2-pyridinyl)-1,2,4-thiadiazol-5-yl]oxolane-2-carboxamide
CID 126828954
N-(2-phenylphenyl)oxolane-2-carboxamide
CID 2995133
2-amino-N-(2-chloro-3-pyridinyl)cyclohexane-1-carboxamide
CID 64822363
(2R)-N-(2-chloro-4-pyridinyl)oxolane-2-carboxamide
CID 129370669

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide?
The IUPAC name of N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide (CID 4166852) is N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide is O=C(Nc1cccnc1Cl)C1CCCO1.
What is the InChIKey of N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide?
The InChIKey is LYXSOXQHIFFCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O2/c11-9-7(3-1-5-12-9)13-10(14)8-4-2-6-15-8/h1,3,5,8H,2,4,6H2,(H,13,14).
What are the key properties of N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide?
N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide has a molecular weight of 226.66 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-3-pyridinyl)oxolane-2-carboxamide is sourced from PubChem (CID 4166852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).