N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide

C15H23N3O — CID 61212881

IUPACN-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
SMILESCNC(=O)CNC1CCN(CCc2ccccc2)C1
InChIInChI=1S/C15H23N3O/c1-16-15(19)11-17-14-8-10-18(12-14)9-7-13-5-3-2-4-6-13/h2-6,14,17H,7-12H2,1H3,(H,16,19)
InChIKeyZAKOQTKYPBGQMD-UHFFFAOYSA-N
MW261.37 g/mol
LogP0.64
Rot. Bonds6

About N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide

N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide (PubChem CID 61212881) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
PubChem CID61212881
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
SMILESCNC(=O)CNC1CCN(CCc2ccccc2)C1
InChIInChI=1S/C15H23N3O/c1-16-15(19)11-17-14-8-10-18(12-14)9-7-13-5-3-2-4-6-13/h2-6,14,17H,7-12H2,1H3,(H,16,19)
InChIKeyZAKOQTKYPBGQMD-UHFFFAOYSA-N
XLogP0.64
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 ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-(2-phenylethyl)piperidin-4-yl]amino]-N-propylacetamide
CID 119164761
2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]ethanol
CID 61212508
N,N-dimethyl-2-[[1-(2-phenylethyl)piperidin-4-yl]amino]acetamide
CID 60796882
1-(2-phenylethyl)-N-prop-2-ynylpyrrolidin-3-amine
CID 61211753
2-[(1-benzylpyrrolidin-3-yl)amino]-N-tert-butylacetamide
CID 78913239
2-(methylamino)-N-[[1-(2-phenylethyl)pyrrolidin-3-yl]methyl]acetamide
CID 120704332
2-[[1-(2-phenylethyl)piperidin-4-yl]amino]propanoic acid
CID 61499758
N-(2,3-dimethylbutyl)-1-(2-phenylethyl)pyrrolidin-3-amine
CID 64570465
1,3-dimethyl-1-[1-(2-phenylethyl)piperidin-4-yl]urea
CID 91557912
(3R)-N-methyl-1-(3-phenylpropyl)pyrrolidin-3-amine
CID 142940640
5-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]pentan-2-ol
CID 107267756
(3R)-N-[2-(methylamino)-2-oxoethyl]-1-[1-(2-phenylethyl)piperidin-4-yl]piperidine-3-carboxamide
CID 95402897

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
The IUPAC name of N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide (CID 61212881) is N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide.
What is the SMILES notation for N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
The canonical SMILES for N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide is CNC(=O)CNC1CCN(CCc2ccccc2)C1.
What is the InChIKey of N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
The InChIKey is ZAKOQTKYPBGQMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-16-15(19)11-17-14-8-10-18(12-14)9-7-13-5-3-2-4-6-13/h2-6,14,17H,7-12H2,1H3,(H,16,19).
What are the key properties of N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide has a molecular weight of 261.37 g/mol, XLogP of 0.64, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide is sourced from PubChem (CID 61212881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).