5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

C17H28N4O2 — CID 109185688

IUPAC5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESCCCCN(C)c1ccc(C(=O)NCCN2CCOCC2)nc1
InChIInChI=1S/C17H28N4O2/c1-3-4-8-20(2)15-5-6-16(19-14-15)17(22)18-7-9-21-10-12-23-13-11-21/h5-6,14H,3-4,7-13H2,1-2H3,(H,18,22)
InChIKeyLJOULXAMYFFRHX-UHFFFAOYSA-N
MW320.44 g/mol
LogP1.38
Rot. Bonds8

About 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide

5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (PubChem CID 109185688) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
PubChem CID109185688
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Name5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
SMILESCCCCN(C)c1ccc(C(=O)NCCN2CCOCC2)nc1
InChIInChI=1S/C17H28N4O2/c1-3-4-8-20(2)15-5-6-16(19-14-15)17(22)18-7-9-21-10-12-23-13-11-21/h5-6,14H,3-4,7-13H2,1-2H3,(H,18,22)
InChIKeyLJOULXAMYFFRHX-UHFFFAOYSA-N
XLogP1.38
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Saruparib
CID 155586901
N2,N4-Bis(2-methoxyethyl)-2,4-pyridinedicarboxamide
CID 60788
5-[4-[(3-ethyl-2-oxidanylidene-1~{H}-quinolin-7-yl)methyl]piperazin-1-yl]-~{N}-methyl-pyridine-2-carboxamide
CID 156596360
Piperazine carbamate/urea derivative 3
CID 89487899
N-[6-methyl-5-(1-methyl-5-morpholin-4-yl-6-oxopyridin-3-yl)pyridin-3-yl]-3-(trifluoromethyl)benzamide
CID 90442604
N-(1',2-dimethyl-5'-morpholino-6'-oxo-1',6'-dihydro-[3,3'-bipyridin]-5-yl)-2-(trifluoromethyl)isonicotinamide
CID 117609603
N-[6-methyl-5-(5-morpholin-4-yl-6-oxo-1H-pyridin-3-yl)pyridin-3-yl]-3-(trifluoromethyl)benzamide
CID 117610044
5-[[(3R)-1-[(7-ethyl-6-oxo-5H-1,5-naphthyridin-3-yl)methyl]pyrrolidin-3-yl]amino]-N-methylpyridine-2-carboxamide
CID 168177312
5-[6-[(7-ethyl-6-oxo-5H-1,5-naphthyridin-3-yl)methyl]-2,6-diazaspiro[3.3]heptan-2-yl]-N-methylpyridine-2-carboxamide
CID 168177317
5-[[1-[(7-ethyl-6-oxo-5H-1,5-naphthyridin-3-yl)methyl]pyrrolidin-3-yl]amino]-N-methylpyridine-2-carboxamide
CID 168177329
Piperazine-1,4-diylbis(pyridin-2-ylmethanone)
CID 258989
N-cyclohexylpyridine-2-carboxamide
CID 10608271

Frequently Asked Questions

What is the IUPAC name of 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The IUPAC name of 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide (CID 109185688) is 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is CCCCN(C)c1ccc(C(=O)NCCN2CCOCC2)nc1.
What is the InChIKey of 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
The InChIKey is LJOULXAMYFFRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2/c1-3-4-8-20(2)15-5-6-16(19-14-15)17(22)18-7-9-21-10-12-23-13-11-21/h5-6,14H,3-4,7-13H2,1-2H3,(H,18,22).
What are the key properties of 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide?
5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide has a molecular weight of 320.44 g/mol, XLogP of 1.38, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 109185688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).