N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide

C16H28N6O2 — CID 119830188

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide
SMILESCC(C)(CNC(=O)c1cn(C2CCNCC2)nn1)N1CCOCC1
InChIInChI=1S/C16H28N6O2/c1-16(2,21-7-9-24-10-8-21)12-18-15(23)14-11-22(20-19-14)13-3-5-17-6-4-13/h11,13,17H,3-10,12H2,1-2H3,(H,18,23)
InChIKeyJYMQJQLYBXNJDB-UHFFFAOYSA-N
MW336.44 g/mol
LogP0.04
Rot. Bonds5

About N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide

N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide (PubChem CID 119830188) has the molecular formula C16H28N6O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide
PubChem CID119830188
Molecular FormulaC16H28N6O2
Molecular Weight336.44 g/mol
Exact Mass336.23
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide
SMILESCC(C)(CNC(=O)c1cn(C2CCNCC2)nn1)N1CCOCC1
InChIInChI=1S/C16H28N6O2/c1-16(2,21-7-9-24-10-8-21)12-18-15(23)14-11-22(20-19-14)13-3-5-17-6-4-13/h11,13,17H,3-10,12H2,1-2H3,(H,18,23)
InChIKeyJYMQJQLYBXNJDB-UHFFFAOYSA-N
XLogP0.04
TPSA84.31 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 50.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-1-piperidin-4-yltriazole-4-carboxamide
CID 119850016
methyl 2-[(1-piperidin-4-yltriazole-4-carbonyl)amino]acetate
CID 63283122
N-(3-ethyl-2-morpholin-4-ylpentyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119841672
N-(2-methylpropyl)-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119673779
ethyl 2-[(1-piperidin-4-yltriazole-4-carbonyl)amino]acetate
CID 63283121
N-(2-morpholin-4-yl-2-phenylethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119853215
N-(2-acetamidoethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 63283255
N-(2-hydroxy-4,4-dimethylpentyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119793062
N-[2-methyl-2-[3-(trifluoromethyl)phenyl]propyl]-1-piperidin-4-yltriazole-4-carboxamide
CID 119771408
2-(oxan-4-yl)-1-(1-piperidin-4-yltriazol-4-yl)ethanone
CID 116567860
N-(2-cyclohexylethyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 119725715
1-piperidin-4-yl-N-(2H-tetrazol-5-ylmethyl)triazole-4-carboxamide
CID 63284483

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide (CID 119830188) is N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide is CC(C)(CNC(=O)c1cn(C2CCNCC2)nn1)N1CCOCC1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide?
The InChIKey is JYMQJQLYBXNJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N6O2/c1-16(2,21-7-9-24-10-8-21)12-18-15(23)14-11-22(20-19-14)13-3-5-17-6-4-13/h11,13,17H,3-10,12H2,1-2H3,(H,18,23).
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide?
N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 0.04, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-morpholin-4-ylpropyl)-1-piperidin-4-yltriazole-4-carboxamide is sourced from PubChem (CID 119830188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).