2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide

C8H16N2O2 — CID 90442595

IUPAC2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide
SMILESCOCC(=O)N[C@@H]1CCN(C)C1
InChIInChI=1S/C8H16N2O2/c1-10-4-3-7(5-10)9-8(11)6-12-2/h7H,3-6H2,1-2H3,(H,9,11)/t7-/m1/s1
InChIKeyXSKLEIIVJJAQTM-SSDOTTSWSA-N
MW172.23 g/mol
LogP-0.55
Rot. Bonds3

About 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide

2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide (PubChem CID 90442595) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide
PubChem CID90442595
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide
SMILESCOCC(=O)N[C@@H]1CCN(C)C1
InChIInChI=1S/C8H16N2O2/c1-10-4-3-7(5-10)9-8(11)6-12-2/h7H,3-6H2,1-2H3,(H,9,11)/t7-/m1/s1
InChIKeyXSKLEIIVJJAQTM-SSDOTTSWSA-N
XLogP-0.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(1-methylazetidin-3-yl)acetamide
CID 23557883
methyl 3-[(1-methylpyrrolidin-3-yl)amino]-3-oxopropanoate
CID 115174182
5-[(1-methylpyrrolidin-3-yl)amino]-5-oxopentanoic acid
CID 61462313
N-(1-methylpyrrolidin-3-yl)butanamide
CID 18723360
3-amino-N-(1-methylpyrrolidin-3-yl)propanamide
CID 61465444
ethane;methoxymethane;N-(1-methylpyrrolidin-3-yl)acetamide
CID 169257856
2-cyano-N-(1-methylpyrrolidin-3-yl)acetamide
CID 61465317
4-hydroxy-N-(1-methylpyrrolidin-3-yl)butanamide
CID 79192658
ethyl N-(1-methylpyrrolidin-3-yl)carbamate
CID 61355543
N-(1-methylpyrrolidin-3-yl)-12-oxotridecanamide
CID 169229027
N-[1-(2-bromoacetyl)piperidin-4-yl]-2-methoxyacetamide
CID 63680285
2-methoxy-N-(1-methylsulfonylpiperidin-3-yl)acetamide
CID 47403795

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide?
The IUPAC name of 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide (CID 90442595) is 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide.
What is the SMILES notation for 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide?
The canonical SMILES for 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide is COCC(=O)N[C@@H]1CCN(C)C1.
What is the InChIKey of 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide?
The InChIKey is XSKLEIIVJJAQTM-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-10-4-3-7(5-10)9-8(11)6-12-2/h7H,3-6H2,1-2H3,(H,9,11)/t7-/m1/s1.
What are the key properties of 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide?
2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide has a molecular weight of 172.23 g/mol, XLogP of -0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(3R)-1-methylpyrrolidin-3-yl]acetamide is sourced from PubChem (CID 90442595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).