2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide

C17H28N4O2 — CID 111750289

IUPAC2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide
SMILESCN(CC(=O)Nc1ccc(N2CCCCC2)nc1)CC(C)(C)O
InChIInChI=1S/C17H28N4O2/c1-17(2,23)13-20(3)12-16(22)19-14-7-8-15(18-11-14)21-9-5-4-6-10-21/h7-8,11,23H,4-6,9-10,12-13H2,1-3H3,(H,19,22)
InChIKeyVCZXREXIEVDZEK-UHFFFAOYSA-N
MW320.44 g/mol
LogP1.71
Rot. Bonds6

About 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide

2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide (PubChem CID 111750289) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide
PubChem CID111750289
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Name2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide
SMILESCN(CC(=O)Nc1ccc(N2CCCCC2)nc1)CC(C)(C)O
InChIInChI=1S/C17H28N4O2/c1-17(2,23)13-20(3)12-16(22)19-14-7-8-15(18-11-14)21-9-5-4-6-10-21/h7-8,11,23H,4-6,9-10,12-13H2,1-3H3,(H,19,22)
InChIKeyVCZXREXIEVDZEK-UHFFFAOYSA-N
XLogP1.71
TPSA68.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(azepan-1-yl)-3-pyridinyl]-2,2-dimethylpropanamide
CID 113015875
2,2-dimethyl-4-oxo-4-[(6-pyrrolidin-1-yl-3-pyridinyl)amino]butanoic acid
CID 65302404
N-[6-(azepan-1-yl)-3-pyridinyl]-2-piperidin-1-ylacetamide
CID 155391895
N-(6-piperidin-1-yl-3-pyridinyl)pentanamide
CID 18144003
2-amino-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 43704585
tert-butyl N-[6-(azepan-1-yl)-3-pyridinyl]carbamate
CID 113015925
3-chloro-2,2-dimethyl-N-(6-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 63679043
3-cyclopentyl-N-(6-piperidin-1-yl-3-pyridinyl)propanamide
CID 52549781
N-[6-(azepan-1-yl)-3-pyridinyl]-3,3-diphenylpropanamide
CID 113015896
3-amino-N-(6-pyrrolidin-1-yl-3-pyridinyl)butanamide
CID 60836509
(2R)-2-amino-3,3-dimethyl-N-(6-piperidin-1-yl-3-pyridinyl)butanamide
CID 103928716
N-[6-(azepan-1-yl)-3-pyridinyl]-2-(cycloheptylamino)acetamide
CID 155391842

Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide?
The IUPAC name of 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide (CID 111750289) is 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide?
The canonical SMILES for 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide is CN(CC(=O)Nc1ccc(N2CCCCC2)nc1)CC(C)(C)O.
What is the InChIKey of 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide?
The InChIKey is VCZXREXIEVDZEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2/c1-17(2,23)13-20(3)12-16(22)19-14-7-8-15(18-11-14)21-9-5-4-6-10-21/h7-8,11,23H,4-6,9-10,12-13H2,1-3H3,(H,19,22).
What are the key properties of 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide?
2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide has a molecular weight of 320.44 g/mol, XLogP of 1.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-(6-piperidin-1-yl-3-pyridinyl)acetamide is sourced from PubChem (CID 111750289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).