6-amino-6-(4-phenylphenyl)hexanamide

C18H22N2O — CID 60862321

IUPAC6-amino-6-(4-phenylphenyl)hexanamide
SMILESNC(=O)CCCCC(N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H22N2O/c19-17(8-4-5-9-18(20)21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-3,6-7,10-13,17H,4-5,8-9,19H2,(H2,20,21)
InChIKeyXPLRFUVCKSQHGH-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.40
Rot. Bonds7

About 6-amino-6-(4-phenylphenyl)hexanamide

6-amino-6-(4-phenylphenyl)hexanamide (PubChem CID 60862321) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is 6-amino-6-(4-phenylphenyl)hexanamide.

Molecular Properties

Compound Name6-amino-6-(4-phenylphenyl)hexanamide
PubChem CID60862321
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name6-amino-6-(4-phenylphenyl)hexanamide
SMILESNC(=O)CCCCC(N)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H22N2O/c19-17(8-4-5-9-18(20)21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-3,6-7,10-13,17H,4-5,8-9,19H2,(H2,20,21)
InChIKeyXPLRFUVCKSQHGH-UHFFFAOYSA-N
XLogP3.40
TPSA69.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-(4-phenylphenyl)pentane-1,5-diamine
CID 171208421
(1R)-1-(4-phenylphenyl)propane-1,3-diamine
CID 171208417
3-amino-3-(4-phenylphenyl)propan-1-ol;hydrochloride
CID 170874439
methyl 7-amino-7-phenylheptanoate
CID 139616773
1-(4-phenylphenyl)butan-1-amine
CID 43197430
4-amino-N-(4-amino-4-oxobutyl)-4-phenylbutanamide
CID 63323993
(1R)-3-fluoro-1-(4-phenylphenyl)propan-1-amine;hydrochloride
CID 171208436
3,5-diamino-4-(4-phenylphenyl)heptanediamide
CID 170876356
(1S)-4,4,4-trifluoro-1-(4-phenylphenyl)butan-1-amine
CID 171228019
6-amino-6-(3-fluoro-4-methoxyphenyl)hexanamide
CID 60860844
6-amino-6-(2,3-dihydro-1-benzofuran-5-yl)hexanamide
CID 54927378
ethyl (3S)-3-amino-3-(4-phenylphenyl)propanoate
CID 29059678

Frequently Asked Questions

What is the IUPAC name of 6-amino-6-(4-phenylphenyl)hexanamide?
The IUPAC name of 6-amino-6-(4-phenylphenyl)hexanamide (CID 60862321) is 6-amino-6-(4-phenylphenyl)hexanamide.
What is the SMILES notation for 6-amino-6-(4-phenylphenyl)hexanamide?
The canonical SMILES for 6-amino-6-(4-phenylphenyl)hexanamide is NC(=O)CCCCC(N)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 6-amino-6-(4-phenylphenyl)hexanamide?
The InChIKey is XPLRFUVCKSQHGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c19-17(8-4-5-9-18(20)21)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-3,6-7,10-13,17H,4-5,8-9,19H2,(H2,20,21).
What are the key properties of 6-amino-6-(4-phenylphenyl)hexanamide?
6-amino-6-(4-phenylphenyl)hexanamide has a molecular weight of 282.39 g/mol, XLogP of 3.40, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-6-(4-phenylphenyl)hexanamide is sourced from PubChem (CID 60862321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).