(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide

C15H22N4O2 — CID 103831459

IUPAC(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide
SMILESCCCC[C@H](N)C(=O)Nc1cccc(N2CCNC2=O)c1
InChIInChI=1S/C15H22N4O2/c1-2-3-7-13(16)14(20)18-11-5-4-6-12(10-11)19-9-8-17-15(19)21/h4-6,10,13H,2-3,7-9,16H2,1H3,(H,17,21)(H,18,20)/t13-/m0/s1
InChIKeyXRIORFHXUWWRDK-ZDUSSCGKSA-N
MW290.37 g/mol
LogP1.67
Rot. Bonds6

About (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide

(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide (PubChem CID 103831459) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide
PubChem CID103831459
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide
SMILESCCCC[C@H](N)C(=O)Nc1cccc(N2CCNC2=O)c1
InChIInChI=1S/C15H22N4O2/c1-2-3-7-13(16)14(20)18-11-5-4-6-12(10-11)19-9-8-17-15(19)21/h4-6,10,13H,2-3,7-9,16H2,1H3,(H,17,21)(H,18,20)/t13-/m0/s1
InChIKeyXRIORFHXUWWRDK-ZDUSSCGKSA-N
XLogP1.67
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]pentanamide;hydrochloride
CID 119338335
2-bromo-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 107903731
N-[3-(2-oxoimidazolidin-1-yl)phenyl]acetamide
CID 47210940
(2S)-2-(2-methylpropoxy)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 94123689
2-amino-N-(3-imidazol-1-ylphenyl)hexanamide
CID 60853484
N-(3-acetamidophenyl)-2-aminohexanamide
CID 60852572
(2S)-2-amino-N-[4-(2-oxoimidazolidin-1-yl)phenyl]butanamide;hydrochloride
CID 119276073
2-methyl-N-[2-[[3-(2-oxoimidazolidin-1-yl)phenyl]carbamoylamino]ethyl]propanamide
CID 47039442
2-amino-N-[3-(5-methyltetrazol-1-yl)phenyl]hexanamide
CID 60854574
3-chloro-2,2-dimethyl-N-[3-(2-oxoimidazolidin-1-yl)phenyl]propanamide
CID 63679045
N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]acetamide
CID 79026340
1-(2-methylprop-2-enyl)-3-[3-(2-oxoimidazolidin-1-yl)phenyl]urea
CID 100624959

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide?
The IUPAC name of (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide (CID 103831459) is (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide.
What is the SMILES notation for (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide?
The canonical SMILES for (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide is CCCC[C@H](N)C(=O)Nc1cccc(N2CCNC2=O)c1.
What is the InChIKey of (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide?
The InChIKey is XRIORFHXUWWRDK-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-2-3-7-13(16)14(20)18-11-5-4-6-12(10-11)19-9-8-17-15(19)21/h4-6,10,13H,2-3,7-9,16H2,1H3,(H,17,21)(H,18,20)/t13-/m0/s1.
What are the key properties of (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide?
(2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide has a molecular weight of 290.37 g/mol, XLogP of 1.67, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[3-(2-oxoimidazolidin-1-yl)phenyl]hexanamide is sourced from PubChem (CID 103831459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).