N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide

C15H23N3O2 — CID 109228614

IUPACN-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C15H23N3O2/c1-12(2)3-4-17-15(19)13-9-14(11-16-10-13)18-5-7-20-8-6-18/h9-12H,3-8H2,1-2H3,(H,17,19)
InChIKeyLWIBIWCSUHRIJV-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.69
Rot. Bonds5

About N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide

N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide (PubChem CID 109228614) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide
PubChem CID109228614
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide
SMILESCC(C)CCNC(=O)c1cncc(N2CCOCC2)c1
InChIInChI=1S/C15H23N3O2/c1-12(2)3-4-17-15(19)13-9-14(11-16-10-13)18-5-7-20-8-6-18/h9-12H,3-8H2,1-2H3,(H,17,19)
InChIKeyLWIBIWCSUHRIJV-UHFFFAOYSA-N
XLogP1.69
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-morpholin-4-yl-N-propan-2-ylpyridine-3-carboxamide
CID 109223170
N-(3-methylbutyl)-5-[4-(3-methylphenyl)piperazin-1-yl]pyridine-3-carboxamide
CID 109238422
N-butan-2-yl-5-morpholin-4-ylpyridine-3-carboxamide
CID 109225123
5-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(3-methylbutyl)pyridine-3-carboxamide
CID 109238474
N-(3-methylbutyl)-5-[4-(4-methylpiperazin-1-yl)anilino]pyridine-3-carboxamide
CID 109239859
N-[(2-methylphenyl)methyl]-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228561
5-(4-ethylpiperazin-1-yl)-N-(2-methylpropyl)pyridine-3-carboxamide
CID 109224744
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyridine-3-carboxamide
CID 109239784
5-(3-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229499
N-(3-methylbutyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102896
N-(3,4-dimethylphenyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228634
5-bromo-N-(3-methylbutyl)pyridine-3-carboxamide
CID 21352689

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide?
The IUPAC name of N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide (CID 109228614) is N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide?
The canonical SMILES for N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide is CC(C)CCNC(=O)c1cncc(N2CCOCC2)c1.
What is the InChIKey of N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide?
The InChIKey is LWIBIWCSUHRIJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-12(2)3-4-17-15(19)13-9-14(11-16-10-13)18-5-7-20-8-6-18/h9-12H,3-8H2,1-2H3,(H,17,19).
What are the key properties of N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide?
N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 109228614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).