(2S)-2-amino-N-(2-phenylphenyl)hexanamide

C18H22N2O — CID 103830910

IUPAC(2S)-2-amino-N-(2-phenylphenyl)hexanamide
SMILESCCCC[C@H](N)C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C18H22N2O/c1-2-3-12-16(19)18(21)20-17-13-8-7-11-15(17)14-9-5-4-6-10-14/h4-11,13,16H,2-3,12,19H2,1H3,(H,20,21)/t16-/m0/s1
InChIKeyGHLHKIZLKZBSLK-INIZCTEOSA-N
MW282.39 g/mol
LogP3.81
Rot. Bonds6

About (2S)-2-amino-N-(2-phenylphenyl)hexanamide

(2S)-2-amino-N-(2-phenylphenyl)hexanamide (PubChem CID 103830910) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is (2S)-2-amino-N-(2-phenylphenyl)hexanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2-phenylphenyl)hexanamide
PubChem CID103830910
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name(2S)-2-amino-N-(2-phenylphenyl)hexanamide
SMILESCCCC[C@H](N)C(=O)Nc1ccccc1-c1ccccc1
InChIInChI=1S/C18H22N2O/c1-2-3-12-16(19)18(21)20-17-13-8-7-11-15(17)14-9-5-4-6-10-14/h4-11,13,16H,2-3,12,19H2,1H3,(H,20,21)/t16-/m0/s1
InChIKeyGHLHKIZLKZBSLK-INIZCTEOSA-N
XLogP3.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(2-chlorophenyl)hexanamide
CID 103830834
2-amino-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]hexanamide
CID 60852236
2-butylsulfanyl-N-(2-phenylphenyl)propanamide
CID 112781235
2-amino-N-(2-methylsulfonylphenyl)hexanamide
CID 54928189
2-amino-N-(2-hydroxy-3-methylphenyl)hexanamide
CID 79596538
2-amino-N-(2-phenylpyrimidin-5-yl)hexanamide
CID 60854044
2-amino-N-[2-(2-methylpropoxy)phenyl]hexanamide
CID 60928386
(2R)-2-phenyl-N-(2-phenylphenyl)butanamide
CID 1328236
N-(2-phenylphenyl)acetamide;propan-1-ol
CID 175030859
diethyl 2-[(2-phenylphenyl)carbamoylamino]propanedioate
CID 3756272
(2S)-2-amino-N-(2,6-diethylphenyl)hexanamide
CID 107143829
3-(2-aminohexanoylamino)-N,2-dimethylbenzamide
CID 60854743

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2-phenylphenyl)hexanamide?
The IUPAC name of (2S)-2-amino-N-(2-phenylphenyl)hexanamide (CID 103830910) is (2S)-2-amino-N-(2-phenylphenyl)hexanamide.
What is the SMILES notation for (2S)-2-amino-N-(2-phenylphenyl)hexanamide?
The canonical SMILES for (2S)-2-amino-N-(2-phenylphenyl)hexanamide is CCCC[C@H](N)C(=O)Nc1ccccc1-c1ccccc1.
What is the InChIKey of (2S)-2-amino-N-(2-phenylphenyl)hexanamide?
The InChIKey is GHLHKIZLKZBSLK-INIZCTEOSA-N. The full InChI is InChI=1S/C18H22N2O/c1-2-3-12-16(19)18(21)20-17-13-8-7-11-15(17)14-9-5-4-6-10-14/h4-11,13,16H,2-3,12,19H2,1H3,(H,20,21)/t16-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2-phenylphenyl)hexanamide?
(2S)-2-amino-N-(2-phenylphenyl)hexanamide has a molecular weight of 282.39 g/mol, XLogP of 3.81, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(2-phenylphenyl)hexanamide is sourced from PubChem (CID 103830910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).