(2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide

C11H13ClN2O2 — CID 126837047

IUPAC(2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide
SMILESCN(C(=O)[C@H]1CCCO1)c1cccc(Cl)n1
InChIInChI=1S/C11H13ClN2O2/c1-14(10-6-2-5-9(12)13-10)11(15)8-4-3-7-16-8/h2,5-6,8H,3-4,7H2,1H3/t8-/m1/s1
InChIKeyUYFZXZCQWMTQOU-MRVPVSSYSA-N
MW240.69 g/mol
LogP1.88
Rot. Bonds2

About (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide

(2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide (PubChem CID 126837047) has the molecular formula C11H13ClN2O2 and a molecular weight of 240.69 g/mol. Its IUPAC name is (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide
PubChem CID126837047
Molecular FormulaC11H13ClN2O2
Molecular Weight240.69 g/mol
Exact Mass240.07
IUPAC Name(2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide
SMILESCN(C(=O)[C@H]1CCCO1)c1cccc(Cl)n1
InChIInChI=1S/C11H13ClN2O2/c1-14(10-6-2-5-9(12)13-10)11(15)8-4-3-7-16-8/h2,5-6,8H,3-4,7H2,1H3/t8-/m1/s1
InChIKeyUYFZXZCQWMTQOU-MRVPVSSYSA-N
XLogP1.88
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.69
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(N'-hydroxycarbamimidoyl)phenyl]-N-methyloxolane-2-carboxamide
CID 76979502
N-methyl-N-(3-nitrophenyl)oxolane-2-carboxamide
CID 75388553
(2R)-N-methyl-N-(5-pyridin-2-yl-1,3,4-thiadiazol-2-yl)oxolane-2-carboxamide
CID 1446968
N-methyl-N-(3-phenyl-1,2,4-thiadiazol-5-yl)oxane-2-carboxamide
CID 138009565
N-[4-(aminomethyl)phenyl]-N-methyloxane-2-carboxamide
CID 55048035
6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyridine-2-carboxamide
CID 55052209
N-cyclobutyl-N-methyloxolane-2-carboxamide
CID 127002329
(2S)-N-methyl-N-[5-(5-methylpyrazin-2-yl)-1,3,4-thiadiazol-2-yl]oxolane-2-carboxamide
CID 1446995
N-methyl-N-(1-methylbenzimidazol-5-yl)oxolane-2-carboxamide
CID 110869282
(2S)-N-[2-(2-chloroanilino)-2-oxoethyl]-N-methyloxolane-2-carboxamide
CID 38632443
N-[(2-aminophenyl)methyl]-N-methyloxolane-2-carboxamide
CID 43458438
(2R)-N-[(3-chloro-1-benzothiophen-2-yl)methyl]-N-methyloxolane-2-carboxamide
CID 56753523

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide?
The IUPAC name of (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide (CID 126837047) is (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide?
The canonical SMILES for (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide is CN(C(=O)[C@H]1CCCO1)c1cccc(Cl)n1.
What is the InChIKey of (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide?
The InChIKey is UYFZXZCQWMTQOU-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H13ClN2O2/c1-14(10-6-2-5-9(12)13-10)11(15)8-4-3-7-16-8/h2,5-6,8H,3-4,7H2,1H3/t8-/m1/s1.
What are the key properties of (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide?
(2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide has a molecular weight of 240.69 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(6-chloro-2-pyridinyl)-N-methyloxolane-2-carboxamide is sourced from PubChem (CID 126837047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).