3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide

C14H23N3O2 — CID 54177761

IUPAC3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
SMILESCC(=O)NCC1CCCN1C.COc1cccnc1
InChIInChI=1S/C8H16N2O.C6H7NO/c1-7(11)9-6-8-4-3-5-10(8)2;1-8-6-3-2-4-7-5-6/h8H,3-6H2,1-2H3,(H,9,11);2-5H,1H3
InChIKeyOZQCOVHVBFTRAQ-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.31
Rot. Bonds3

About 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide

3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide (PubChem CID 54177761) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide.

Molecular Properties

Compound Name3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
PubChem CID54177761
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide
SMILESCC(=O)NCC1CCCN1C.COc1cccnc1
InChIInChI=1S/C8H16N2O.C6H7NO/c1-7(11)9-6-8-4-3-5-10(8)2;1-8-6-3-2-4-7-5-6/h8H,3-6H2,1-2H3,(H,9,11);2-5H,1H3
InChIKeyOZQCOVHVBFTRAQ-UHFFFAOYSA-N
XLogP1.31
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-3-carboxamide
CID 103872767
2-methoxy-N-[(1-methylpyrrolidin-2-yl)methyl]benzamide
CID 47416436
(E)-but-2-enedioic acid;3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]pyridine
CID 66629517
3-(methylamino)-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-4-carboxamide
CID 114138605
3-[(1-methylpyrrolidin-2-yl)methylamino]pyridine-2-carboxylic acid
CID 106022139
2-(1-methylpyrrolidin-2-yl)-N-[2-(pyridin-3-ylamino)ethyl]acetamide
CID 74233941
2,5-dimethoxy-N-[(1-methylpiperidin-2-yl)methyl]benzamide
CID 23390396
3-amino-N-[(1-methylpiperidin-2-yl)methyl]pyridine-2-carboxamide
CID 113447691
N-[2-[1-(pyridine-3-carbonyl)pyrrolidin-2-yl]ethyl]acetamide
CID 127245085
2-amino-4-methoxy-N-[(1-methylpiperidin-2-yl)methyl]benzamide
CID 115413083
3-[(1-methylpyrrolidin-2-yl)methylcarbamoylamino]pyridine-2-carboxylic acid
CID 106020866
1-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-3-(4-pyridin-3-yloxyphenyl)urea
CID 124755518

Frequently Asked Questions

What is the IUPAC name of 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide?
The IUPAC name of 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide (CID 54177761) is 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide.
What is the SMILES notation for 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide?
The canonical SMILES for 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide is CC(=O)NCC1CCCN1C.COc1cccnc1.
What is the InChIKey of 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide?
The InChIKey is OZQCOVHVBFTRAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.C6H7NO/c1-7(11)9-6-8-4-3-5-10(8)2;1-8-6-3-2-4-7-5-6/h8H,3-6H2,1-2H3,(H,9,11);2-5H,1H3.
What are the key properties of 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide?
3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxypyridine;N-[(1-methylpyrrolidin-2-yl)methyl]acetamide is sourced from PubChem (CID 54177761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).