4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide

C14H20ClN3O2 — CID 81226039

IUPAC4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)NCCCN2CCOCC2)cn1
InChIInChI=1S/C14H20ClN3O2/c1-11-9-13(15)12(10-17-11)14(19)16-3-2-4-18-5-7-20-8-6-18/h9-10H,2-8H2,1H3,(H,16,19)
InChIKeyLRDSYNRPJVCKNX-UHFFFAOYSA-N
MW297.79 g/mol
LogP1.50
Rot. Bonds5

About 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide

4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide (PubChem CID 81226039) has the molecular formula C14H20ClN3O2 and a molecular weight of 297.79 g/mol. Its IUPAC name is 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide
PubChem CID81226039
Molecular FormulaC14H20ClN3O2
Molecular Weight297.79 g/mol
Exact Mass297.12
IUPAC Name4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide
SMILESCc1cc(Cl)c(C(=O)NCCCN2CCOCC2)cn1
InChIInChI=1S/C14H20ClN3O2/c1-11-9-13(15)12(10-17-11)14(19)16-3-2-4-18-5-7-20-8-6-18/h9-10H,2-8H2,1H3,(H,16,19)
InChIKeyLRDSYNRPJVCKNX-UHFFFAOYSA-N
XLogP1.50
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.79
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-chloro-6-methyl-N-(3-pyrazol-1-ylpropyl)pyridine-3-carboxamide
CID 112701067
4-chloro-N-decyl-6-methylpyridine-3-carboxamide
CID 81227523
5-bromo-2-chloro-N-(3-morpholin-4-ylpropyl)benzamide
CID 51155963
3,4-dichloro-N-(3-morpholin-4-ylpropyl)benzamide
CID 3328171
2-chloro-4-[methyl(methylsulfonyl)amino]-N-(3-morpholin-4-ylpropyl)benzamide
CID 50945225
2-methyl-N-(3-morpholin-4-ylpropyl)-1H-imidazole-5-carboxamide
CID 110467560
3,5-dichloro-4-ethoxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 17013971
2-chloro-5-(dimethylsulfamoyl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 8884146
3-amino-N-(3-morpholin-4-ylpropyl)pyridine-4-carboxamide
CID 105068500
2-amino-5-chloro-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 114921931
2-amino-4-chloro-N-(3-morpholin-4-ylpropyl)benzamide
CID 43168459
4-fluoro-2-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 115745095

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide (CID 81226039) is 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide is Cc1cc(Cl)c(C(=O)NCCCN2CCOCC2)cn1.
What is the InChIKey of 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide?
The InChIKey is LRDSYNRPJVCKNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN3O2/c1-11-9-13(15)12(10-17-11)14(19)16-3-2-4-18-5-7-20-8-6-18/h9-10H,2-8H2,1H3,(H,16,19).
What are the key properties of 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide?
4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide has a molecular weight of 297.79 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methyl-N-(3-morpholin-4-ylpropyl)pyridine-3-carboxamide is sourced from PubChem (CID 81226039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).