N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide

C15H23N3O — CID 43221678

IUPACN-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide
SMILESCCNC(=O)CNCc1ccccc1N1CCCC1
InChIInChI=1S/C15H23N3O/c1-2-17-15(19)12-16-11-13-7-3-4-8-14(13)18-9-5-6-10-18/h3-4,7-8,16H,2,5-6,9-12H2,1H3,(H,17,19)
InChIKeyRYXGRCMIUODWOZ-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.51
Rot. Bonds6

About N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide

N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide (PubChem CID 43221678) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide
PubChem CID43221678
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide
SMILESCCNC(=O)CNCc1ccccc1N1CCCC1
InChIInChI=1S/C15H23N3O/c1-2-17-15(19)12-16-11-13-7-3-4-8-14(13)18-9-5-6-10-18/h3-4,7-8,16H,2,5-6,9-12H2,1H3,(H,17,19)
InChIKeyRYXGRCMIUODWOZ-UHFFFAOYSA-N
XLogP1.51
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetate
CID 54921193
N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide
CID 43398909
N-ethyl-2-[(4-pyrrolidin-1-ylphenyl)methylamino]acetamide
CID 43777709
3-[(2-pyrrolidin-1-ylphenyl)methylamino]propanamide
CID 43777430
N-ethyl-2-[(4-piperidin-1-ylphenyl)methylamino]acetamide
CID 43398950
2-(2-piperidin-1-ylphenyl)acetohydrazide
CID 10847264
N-[[2-(4,4-dimethylpiperidin-1-yl)phenyl]methyl]ethanamine
CID 62932460
N-[(2-pyrrolidin-1-ylphenyl)methyl]but-2-yn-1-amine
CID 113342039
N',N'-dimethyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethane-1,2-diamine
CID 43220494
2-ethoxy-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamine
CID 43778380
N-[(2-bromophenyl)methyl]-1-(2-pyrrolidin-1-ylphenyl)methanamine
CID 61402192
1-[[(2-pyrrolidin-1-ylphenyl)methylamino]methyl]cyclobutan-1-ol
CID 115621560

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide?
The IUPAC name of N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide (CID 43221678) is N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide is CCNC(=O)CNCc1ccccc1N1CCCC1.
What is the InChIKey of N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide?
The InChIKey is RYXGRCMIUODWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-17-15(19)12-16-11-13-7-3-4-8-14(13)18-9-5-6-10-18/h3-4,7-8,16H,2,5-6,9-12H2,1H3,(H,17,19).
What are the key properties of N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide?
N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide has a molecular weight of 261.37 g/mol, XLogP of 1.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide is sourced from PubChem (CID 43221678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).