4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide

C14H20N2O2 — CID 61214153

IUPAC4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)NC(C)c2ccccc2)C1
InChIInChI=1S/C14H20N2O2/c1-10(11-6-4-3-5-7-11)16-14(17)13-8-12(18-2)9-15-13/h3-7,10,12-13,15H,8-9H2,1-2H3,(H,16,17)
InChIKeyJFFYWQDTILSOGA-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.24
Rot. Bonds4

About 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide

4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide (PubChem CID 61214153) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide
PubChem CID61214153
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide
SMILESCOC1CNC(C(=O)NC(C)c2ccccc2)C1
InChIInChI=1S/C14H20N2O2/c1-10(11-6-4-3-5-7-11)16-14(17)13-8-12(18-2)9-15-13/h3-7,10,12-13,15H,8-9H2,1-2H3,(H,16,17)
InChIKeyJFFYWQDTILSOGA-UHFFFAOYSA-N
XLogP1.24
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-(4-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81349681
4-methoxy-N-[1-(4-methylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 61213616
N-[(1S)-1-(3-fluorophenyl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 81366720
4-methoxy-N-[(1R)-1-(3-methoxyphenyl)ethyl]pyrrolidine-2-carboxamide
CID 81373074
4-methoxy-N-[1-(2-methylphenyl)ethyl]pyrrolidine-2-carboxamide
CID 61260072
N-[1-(furan-2-yl)ethyl]-4-methoxypyrrolidine-2-carboxamide
CID 61213451
N-[2-(dimethylamino)-1-phenylethyl]-4-methoxypyrrolidine-2-carboxamide
CID 61248362
4-methoxy-N-propan-2-ylpyrrolidine-2-carboxamide
CID 61213428
4-methoxy-N-phenylpyrrolidine-2-carboxamide
CID 61213145
3-[(4-methoxypyrrolidine-2-carbonyl)amino]-2-methylbutanoic acid
CID 113416438
N-(1-cyclopropylethyl)-4-methoxypyrrolidine-2-carboxamide
CID 61213308
4-methoxy-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]pyrrolidine-2-carboxamide
CID 112703598

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide (CID 61214153) is 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide is COC1CNC(C(=O)NC(C)c2ccccc2)C1.
What is the InChIKey of 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide?
The InChIKey is JFFYWQDTILSOGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(11-6-4-3-5-7-11)16-14(17)13-8-12(18-2)9-15-13/h3-7,10,12-13,15H,8-9H2,1-2H3,(H,16,17).
What are the key properties of 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide?
4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(1-phenylethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 61214153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).