3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide

C17H25N3O3 — CID 132948438

IUPAC3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide
SMILESCNC(=O)CCC1(OC)CCCN(C(=O)c2cccnc2C)C1
InChIInChI=1S/C17H25N3O3/c1-13-14(6-4-10-19-13)16(22)20-11-5-8-17(12-20,23-3)9-7-15(21)18-2/h4,6,10H,5,7-9,11-12H2,1-3H3,(H,18,21)
InChIKeyZWDULZBURDYGCN-UHFFFAOYSA-N
MW319.40 g/mol
LogP1.54
Rot. Bonds5

About 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide

3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide (PubChem CID 132948438) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide.

Molecular Properties

Compound Name3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide
PubChem CID132948438
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide
SMILESCNC(=O)CCC1(OC)CCCN(C(=O)c2cccnc2C)C1
InChIInChI=1S/C17H25N3O3/c1-13-14(6-4-10-19-13)16(22)20-11-5-8-17(12-20,23-3)9-7-15(21)18-2/h4,6,10H,5,7-9,11-12H2,1-3H3,(H,18,21)
InChIKeyZWDULZBURDYGCN-UHFFFAOYSA-N
XLogP1.54
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[3-methoxy-1-(4-methyl-1,2,5-oxadiazole-3-carbonyl)piperidin-3-yl]-N-methylpropanamide
CID 132948213
3-[3-methoxy-1-(2-methylpyridine-4-carbonyl)piperidin-3-yl]propanamide
CID 132948118
3-[1-[(E)-3-(1H-imidazol-5-yl)prop-2-enoyl]-3-methoxypiperidin-3-yl]-N-methylpropanamide
CID 132776686
(2-chloro-3-pyridinyl)-(3-methoxy-3-methylpiperidin-1-yl)methanone
CID 107392246
3-[1-(2-chloro-3-fluorobenzoyl)-3-hydroxypiperidin-3-yl]-N-methylpropanamide
CID 132777230
5-[3-methoxy-3-[(2-methylphenoxy)methyl]piperidine-1-carbonyl]-1H-pyrimidin-6-one
CID 132765084
2-methyl-3-[3-[(sulfamoylamino)methyl]piperidine-1-carbonyl]pyridine
CID 78999103
(3R)-N-methyl-3-pyridin-2-yl-1-[2-(pyrrolidin-1-ylmethyl)benzoyl]piperidine-3-carboxamide
CID 124979911
methyl 1-(2-methylpyridine-3-carbonyl)pyrrolidine-3-carboxylate
CID 78950884
(4-amino-3,3-dimethylpiperidin-1-yl)-(2-methyl-3-pyridinyl)methanone;dihydrochloride
CID 120813989
[2-[(4-methoxyoxan-4-yl)methylamino]-3-pyridinyl]-piperidin-1-ylmethanone
CID 133400100
1-(2-methoxypyridine-3-carbonyl)-3-methylpiperidine-3-carboxylic acid
CID 63133754

Frequently Asked Questions

What is the IUPAC name of 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide?
The IUPAC name of 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide (CID 132948438) is 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide.
What is the SMILES notation for 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide?
The canonical SMILES for 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide is CNC(=O)CCC1(OC)CCCN(C(=O)c2cccnc2C)C1.
What is the InChIKey of 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide?
The InChIKey is ZWDULZBURDYGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-13-14(6-4-10-19-13)16(22)20-11-5-8-17(12-20,23-3)9-7-15(21)18-2/h4,6,10H,5,7-9,11-12H2,1-3H3,(H,18,21).
What are the key properties of 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide?
3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide has a molecular weight of 319.40 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-methoxy-1-(2-methylpyridine-3-carbonyl)piperidin-3-yl]-N-methylpropanamide is sourced from PubChem (CID 132948438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).