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

C17H27N3O2 — CID 43050246

IUPAC6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCC(CC(C)C)N2CCOCC2)cn1
InChIInChI=1S/C17H27N3O2/c1-13(2)10-16(20-6-8-22-9-7-20)12-19-17(21)15-5-4-14(3)18-11-15/h4-5,11,13,16H,6-10,12H2,1-3H3,(H,19,21)
InChIKeyAZRSJJFKXNBOFO-UHFFFAOYSA-N
MW305.42 g/mol
LogP1.87
Rot. Bonds6

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

6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide (PubChem CID 43050246) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
PubChem CID43050246
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
SMILESCc1ccc(C(=O)NCC(CC(C)C)N2CCOCC2)cn1
InChIInChI=1S/C17H27N3O2/c1-13(2)10-16(20-6-8-22-9-7-20)12-19-17(21)15-5-4-14(3)18-11-15/h4-5,11,13,16H,6-10,12H2,1-3H3,(H,19,21)
InChIKeyAZRSJJFKXNBOFO-UHFFFAOYSA-N
XLogP1.87
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide (CID 43050246) is 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide is Cc1ccc(C(=O)NCC(CC(C)C)N2CCOCC2)cn1.
What is the InChIKey of 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
The InChIKey is AZRSJJFKXNBOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-13(2)10-16(20-6-8-22-9-7-20)12-19-17(21)15-5-4-14(3)18-11-15/h4-5,11,13,16H,6-10,12H2,1-3H3,(H,19,21).
What are the key properties of 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide?
6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide has a molecular weight of 305.42 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide is sourced from PubChem (CID 43050246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).