N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide

C15H28N4O2 — CID 119566707

IUPACN-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide
SMILESCN(C)CCN1CC(C(=O)NC2(CN)CCCC2)CC1=O
InChIInChI=1S/C15H28N4O2/c1-18(2)7-8-19-10-12(9-13(19)20)14(21)17-15(11-16)5-3-4-6-15/h12H,3-11,16H2,1-2H3,(H,17,21)
InChIKeyUNBXIFVFSDTFGL-UHFFFAOYSA-N
MW296.42 g/mol
LogP-0.22
Rot. Bonds6

About N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide

N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide (PubChem CID 119566707) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide
PubChem CID119566707
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC NameN-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide
SMILESCN(C)CCN1CC(C(=O)NC2(CN)CCCC2)CC1=O
InChIInChI=1S/C15H28N4O2/c1-18(2)7-8-19-10-12(9-13(19)20)14(21)17-15(11-16)5-3-4-6-15/h12H,3-11,16H2,1-2H3,(H,17,21)
InChIKeyUNBXIFVFSDTFGL-UHFFFAOYSA-N
XLogP-0.22
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(aminomethyl)cyclopentyl]-1-[(4-methoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide;hydrochloride
CID 119568459
(3S)-1-[2-(dimethylamino)ethyl]-N-[1-(2-fluorophenyl)cyclopropyl]-5-oxopyrrolidine-3-carboxamide
CID 95931367
N-(3-aminobutyl)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide
CID 119497303
1-[2-(dimethylamino)ethyl]-N-(2-methoxyethyl)-5-oxopyrrolidine-3-carboxamide
CID 113182823
N-(2-amino-2-ethylbutyl)-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide;dihydrochloride
CID 119641855
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 62519112
1-[2-(dimethylamino)ethyl]-5-oxo-N-pyrrolidin-3-ylpyrrolidine-3-carboxamide
CID 119451954
N-[1-(aminomethyl)cyclopentyl]-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide;hydrochloride
CID 119566358
2-[1-[(1-ethyl-5-oxopyrrolidine-3-carbonyl)amino]cyclobutyl]acetic acid
CID 79848389
N-[1-(aminomethyl)cyclopentyl]-1-(2,3-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 119567430
1-[2-(dimethylamino)ethyl]-N-[(2-hydroxy-2-adamantyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 50957220
1-[2-(dimethylamino)ethyl]-5-oxo-N-[[1-(pyrazol-1-ylmethyl)cyclopropyl]methyl]pyrrolidine-3-carboxamide
CID 72875054

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide (CID 119566707) is N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide is CN(C)CCN1CC(C(=O)NC2(CN)CCCC2)CC1=O.
What is the InChIKey of N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide?
The InChIKey is UNBXIFVFSDTFGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-18(2)7-8-19-10-12(9-13(19)20)14(21)17-15(11-16)5-3-4-6-15/h12H,3-11,16H2,1-2H3,(H,17,21).
What are the key properties of N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide?
N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide has a molecular weight of 296.42 g/mol, XLogP of -0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclopentyl]-1-[2-(dimethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 119566707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).