6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide

C10H13ClN2O2 — CID 115410299

IUPAC6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide
SMILESCC(C)CONC(=O)c1cccc(Cl)n1
InChIInChI=1S/C10H13ClN2O2/c1-7(2)6-15-13-10(14)8-4-3-5-9(11)12-8/h3-5,7H,6H2,1-2H3,(H,13,14)
InChIKeyWSISVBMUNOFKPH-UHFFFAOYSA-N
MW228.68 g/mol
LogP2.05
Rot. Bonds4

About 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide

6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide (PubChem CID 115410299) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide
PubChem CID115410299
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide
SMILESCC(C)CONC(=O)c1cccc(Cl)n1
InChIInChI=1S/C10H13ClN2O2/c1-7(2)6-15-13-10(14)8-4-3-5-9(11)12-8/h3-5,7H,6H2,1-2H3,(H,13,14)
InChIKeyWSISVBMUNOFKPH-UHFFFAOYSA-N
XLogP2.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-propan-2-ylpyridine-2-carboxamide
CID 24903389
6-chloro-N-(4-methylpentyl)pyridine-2-carboxamide
CID 62235303
4-methylpentyl 6-chloropyridine-2-carboxylate
CID 63841499
6-chloro-N-(2,3-dimethylbutyl)pyridine-2-carboxamide
CID 64570115
N-(2-methylpropoxy)quinoxaline-2-carboxamide
CID 113304479
6-chloro-N,N-bis(3-methylbutyl)pyridine-2-carboxamide
CID 62234181
N-(2-acetamidoethyl)-6-chloropyridine-2-carboxamide
CID 62234709
6-chloro-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridine-2-carboxamide
CID 55052492
6-chloro-N-[1-(dimethylamino)-3-methylbutan-2-yl]pyridine-2-carboxamide
CID 62233322
3,4-dichloro-N-(2-methylpropoxy)benzamide
CID 115409805
2,3-dihydroxy-N-(2-methylpropoxy)benzamide
CID 114344886
2-chloro-N-(2-methylpropoxy)furan-3-carboxamide
CID 106688367

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide (CID 115410299) is 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide is CC(C)CONC(=O)c1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide?
The InChIKey is WSISVBMUNOFKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-7(2)6-15-13-10(14)8-4-3-5-9(11)12-8/h3-5,7H,6H2,1-2H3,(H,13,14).
What are the key properties of 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide?
6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide has a molecular weight of 228.68 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methylpropoxy)pyridine-2-carboxamide is sourced from PubChem (CID 115410299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).