N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide

C14H20N2O2 — CID 8901770

IUPACN-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
SMILESCOc1ccccc1CNC(=O)CN1CCCC1
InChIInChI=1S/C14H20N2O2/c1-18-13-7-3-2-6-12(13)10-15-14(17)11-16-8-4-5-9-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,15,17)
InChIKeyHWDTXSRXXICEGY-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.41
Rot. Bonds5

About N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide

N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide (PubChem CID 8901770) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
PubChem CID8901770
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide
SMILESCOc1ccccc1CNC(=O)CN1CCCC1
InChIInChI=1S/C14H20N2O2/c1-18-13-7-3-2-6-12(13)10-15-14(17)11-16-8-4-5-9-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,15,17)
InChIKeyHWDTXSRXXICEGY-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azocan-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 51170947
2-(4-fluoropiperidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 171701323
N-[(2-methoxyphenyl)methyl]-2-[(3S)-3-methylpiperidin-1-yl]acetamide
CID 8903458
ethyl 4-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]piperazine-1-carboxylate
CID 8932090
N-[(2-methoxyphenyl)methyl]-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119920219
2-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 171704523
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 78963608
N-[(2-methoxyphenyl)methyl]-2-(4-thiomorpholin-4-ylpiperidin-1-yl)acetamide
CID 91840853
N-[(2-methoxyphenyl)methyl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 8592411
N-[(2-methoxyphenyl)methyl]-2-[3-(methylamino)pyrrolidin-1-yl]acetamide;hydrochloride
CID 119905867
2-(2-formylpiperidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 62654429
N-[(2-methoxyphenyl)methyl]pyrrolidine-1-carboxamide
CID 38150329

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide (CID 8901770) is N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide is COc1ccccc1CNC(=O)CN1CCCC1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide?
The InChIKey is HWDTXSRXXICEGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-18-13-7-3-2-6-12(13)10-15-14(17)11-16-8-4-5-9-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,15,17).
What are the key properties of N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide?
N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 8901770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).