2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide

C15H22N4O2 — CID 60850877

IUPAC2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide
SMILESNCC(=O)NCC(=O)Nc1ccccc1CN1CCCC1
InChIInChI=1S/C15H22N4O2/c16-9-14(20)17-10-15(21)18-13-6-2-1-5-12(13)11-19-7-3-4-8-19/h1-2,5-6H,3-4,7-11,16H2,(H,17,20)(H,18,21)
InChIKeyGVHOMFLRJSBWKB-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.30
Rot. Bonds6

About 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide

2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide (PubChem CID 60850877) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide
PubChem CID60850877
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide
SMILESNCC(=O)NCC(=O)Nc1ccccc1CN1CCCC1
InChIInChI=1S/C15H22N4O2/c16-9-14(20)17-10-15(21)18-13-6-2-1-5-12(13)11-19-7-3-4-8-19/h1-2,5-6H,3-4,7-11,16H2,(H,17,20)(H,18,21)
InChIKeyGVHOMFLRJSBWKB-UHFFFAOYSA-N
XLogP0.30
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4,4,4-trifluoro-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 131911207
4-chloro-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 55204824
2-cyclopentyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 71896430
5-chloro-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 43701552
1-(aminomethyl)-N-[2-(pyrrolidin-1-ylmethyl)phenyl]cyclopropane-1-carboxamide
CID 115452618
2-amino-N-[2-(2-methylanilino)-2-oxoethyl]acetamide
CID 60848997
2-amino-2-ethyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 79814004
N-[2-(piperidin-1-ylmethyl)phenyl]prop-2-enamide
CID 139018823
N-[2-oxo-2-[[2-(piperidin-1-ylmethyl)phenyl]methylamino]ethyl]-2-phenylacetamide
CID 41438782
2-[4-(5-methyltetrazol-1-yl)phenyl]-N-[2-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 131924497
(2R)-2-amino-4-methyl-N-[2-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 104902926
N-[2-(aminomethyl)phenyl]-4-pyrrolidin-1-ylbutanamide
CID 16779594

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide?
The IUPAC name of 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide (CID 60850877) is 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide is NCC(=O)NCC(=O)Nc1ccccc1CN1CCCC1.
What is the InChIKey of 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide?
The InChIKey is GVHOMFLRJSBWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c16-9-14(20)17-10-15(21)18-13-6-2-1-5-12(13)11-19-7-3-4-8-19/h1-2,5-6H,3-4,7-11,16H2,(H,17,20)(H,18,21).
What are the key properties of 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide?
2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide has a molecular weight of 290.37 g/mol, XLogP of 0.30, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-oxo-2-[2-(pyrrolidin-1-ylmethyl)anilino]ethyl]acetamide is sourced from PubChem (CID 60850877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).