6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide

C15H24ClN3O — CID 38988276

IUPAC6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
SMILESCCN(CC)CCC[C@@H](C)NC(=O)c1ccc(Cl)nc1
InChIInChI=1S/C15H24ClN3O/c1-4-19(5-2)10-6-7-12(3)18-15(20)13-8-9-14(16)17-11-13/h8-9,11-12H,4-7,10H2,1-3H3,(H,18,20)/t12-/m1/s1
InChIKeyNDRNTIUILXDCAC-GFCCVEGCSA-N
MW297.83 g/mol
LogP2.98
Rot. Bonds8

About 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide

6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide (PubChem CID 38988276) has the molecular formula C15H24ClN3O and a molecular weight of 297.83 g/mol. Its IUPAC name is 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
PubChem CID38988276
Molecular FormulaC15H24ClN3O
Molecular Weight297.83 g/mol
Exact Mass297.16
IUPAC Name6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
SMILESCCN(CC)CCC[C@@H](C)NC(=O)c1ccc(Cl)nc1
InChIInChI=1S/C15H24ClN3O/c1-4-19(5-2)10-6-7-12(3)18-15(20)13-8-9-14(16)17-11-13/h8-9,11-12H,4-7,10H2,1-3H3,(H,18,20)/t12-/m1/s1
InChIKeyNDRNTIUILXDCAC-GFCCVEGCSA-N
XLogP2.98
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.83
LogP ≤ 52.98
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

6-amino-N-[5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide
CID 62153221
5-chloro-N-[5-(diethylamino)pentan-2-yl]pyrazine-2-carboxamide
CID 107252414
N-[(2R)-5-(diethylamino)pentan-2-yl]-6-morpholin-4-ylpyridine-3-carboxamide
CID 94813287
6-chloro-N-[1-(diethylamino)ethyl]pyridine-3-carboxamide;hydrochloride
CID 88751278
6-chloro-N-(4-methylsulfinylbutan-2-yl)pyridine-3-carboxamide
CID 115673226
N-[5-(diethylamino)pentan-2-yl]-4-(trifluoromethyl)benzamide
CID 4535202
6-chloro-N-[(2S)-3-methylbutan-2-yl]pyridine-3-carboxamide
CID 28880213
N-(4-amino-4-oxobutan-2-yl)-6-chloropyridine-3-carboxamide
CID 115664808
4-cyano-N-[5-(diethylamino)pentan-2-yl]benzamide
CID 24708648
N-[5-(diethylamino)pentan-2-yl]-5-hydroxypyridine-3-carboxamide
CID 63865105
4-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-N-[(2R)-5-(diethylamino)pentan-2-yl]benzamide
CID 92767970
N-[5-(diethylamino)pentan-2-yl]-2H-triazole-4-carboxamide
CID 78968205

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide (CID 38988276) is 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide is CCN(CC)CCC[C@@H](C)NC(=O)c1ccc(Cl)nc1.
What is the InChIKey of 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide?
The InChIKey is NDRNTIUILXDCAC-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H24ClN3O/c1-4-19(5-2)10-6-7-12(3)18-15(20)13-8-9-14(16)17-11-13/h8-9,11-12H,4-7,10H2,1-3H3,(H,18,20)/t12-/m1/s1.
What are the key properties of 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide?
6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide has a molecular weight of 297.83 g/mol, XLogP of 2.98, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(2R)-5-(diethylamino)pentan-2-yl]pyridine-3-carboxamide is sourced from PubChem (CID 38988276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).