6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide

C16H24ClN3O2 — CID 134027027

IUPAC6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
SMILESCC(C)CC(CNC(=O)c1ccc(Cl)nc1)N1CCOCC1
InChIInChI=1S/C16H24ClN3O2/c1-12(2)9-14(20-5-7-22-8-6-20)11-19-16(21)13-3-4-15(17)18-10-13/h3-4,10,12,14H,5-9,11H2,1-2H3,(H,19,21)
InChIKeyNNYHOPICZZMTAE-UHFFFAOYSA-N
MW325.84 g/mol
LogP2.21
Rot. Bonds6

About 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide

6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide (PubChem CID 134027027) has the molecular formula C16H24ClN3O2 and a molecular weight of 325.84 g/mol. Its IUPAC name is 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
PubChem CID134027027
Molecular FormulaC16H24ClN3O2
Molecular Weight325.84 g/mol
Exact Mass325.16
IUPAC Name6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
SMILESCC(C)CC(CNC(=O)c1ccc(Cl)nc1)N1CCOCC1
InChIInChI=1S/C16H24ClN3O2/c1-12(2)9-14(20-5-7-22-8-6-20)11-19-16(21)13-3-4-15(17)18-10-13/h3-4,10,12,14H,5-9,11H2,1-2H3,(H,19,21)
InChIKeyNNYHOPICZZMTAE-UHFFFAOYSA-N
XLogP2.21
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 43050246
1-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyrazole-4-carboxamide
CID 43050213
N-(4-methyl-2-morpholin-4-ylpentyl)-1H-pyrazole-4-carboxamide
CID 60786494
6-chloro-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]pyridine-3-carboxamide
CID 31334942
2,3-dimethyl-N-(4-methyl-2-morpholin-4-ylpentyl)-1H-indole-5-carboxamide
CID 46540916
4-(difluoromethoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027068
5-bromo-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 55521520
4-(methanesulfonamido)-N-[(2R)-4-methyl-2-morpholin-4-ylpentyl]benzamide
CID 25331278
5-chloro-2-hydroxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 43050180
5-chloro-2-(diethylamino)-N-(4-methyl-2-morpholin-4-ylpentyl)pyrimidine-4-carboxamide
CID 48655928
4-ethoxy-N-[2-[(4-methyl-2-morpholin-4-ylpentyl)amino]-2-oxoethyl]benzamide
CID 55520878
3-methyl-N-[(2R)-4-methyl-2-morpholin-4-ylpentyl]-4-nitrobenzamide
CID 30470681

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
The IUPAC name of 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide (CID 134027027) is 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide is CC(C)CC(CNC(=O)c1ccc(Cl)nc1)N1CCOCC1.
What is the InChIKey of 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
The InChIKey is NNYHOPICZZMTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O2/c1-12(2)9-14(20-5-7-22-8-6-20)11-19-16(21)13-3-4-15(17)18-10-13/h3-4,10,12,14H,5-9,11H2,1-2H3,(H,19,21).
What are the key properties of 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide has a molecular weight of 325.84 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide is sourced from PubChem (CID 134027027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).