2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide

C23H35NO2 — CID 155014131

IUPAC2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide
SMILESO=C(NO)C(Cc1ccccc1)C1CCCC2CCCCCCCC2C1
InChIInChI=1S/C23H35NO2/c25-23(24-26)22(16-18-10-5-4-6-11-18)21-15-9-14-19-12-7-2-1-3-8-13-20(19)17-21/h4-6,10-11,19-22,26H,1-3,7-9,12-17H2,(H,24,25)
InChIKeyKZILASPQNYMVSN-UHFFFAOYSA-N
MW357.54 g/mol
LogP5.52
Rot. Bonds4

About 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide

2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide (PubChem CID 155014131) has the molecular formula C23H35NO2 and a molecular weight of 357.54 g/mol. Its IUPAC name is 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide.

Molecular Properties

Compound Name2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide
PubChem CID155014131
Molecular FormulaC23H35NO2
Molecular Weight357.54 g/mol
Exact Mass357.27
IUPAC Name2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide
SMILESO=C(NO)C(Cc1ccccc1)C1CCCC2CCCCCCCC2C1
InChIInChI=1S/C23H35NO2/c25-23(24-26)22(16-18-10-5-4-6-11-18)21-15-9-14-19-12-7-2-1-3-8-13-20(19)17-21/h4-6,10-11,19-22,26H,1-3,7-9,12-17H2,(H,24,25)
InChIKeyKZILASPQNYMVSN-UHFFFAOYSA-N
XLogP5.52
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.54
LogP ≤ 55.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylamino)-3-phenylpropan-1-ol
CID 102613855
(2R)-2-[(3-cyclopropylcyclohexyl)amino]-3-phenylpropan-1-ol
CID 104926199
(2R,3S)-2-benzyl-3-cyclohexyl-3-hydroxy-N-phenylpropanamide
CID 166439076
2-amino-N-[(1R)-1-cycloheptylethyl]-3-phenylpropanamide
CID 81389396
(2R)-2-amino-N-[(1S)-1-cyclohexylethyl]-3-phenylpropanamide
CID 81386066
(2S)-2-amino-N-(2-cyclohexylcyclopropyl)-3-phenylpropanamide;hydrochloride
CID 119335197
(2S)-2-amino-N-(dicyclopropylmethyl)-3-phenylpropanamide
CID 61248190
4-cyclohexyl-5-oxo-6-phenylhexanoic acid
CID 141190794
3-cyclohexyl-N-hydroxy-2-phenylpropanamide
CID 167915890
(2S)-2-amino-N-(dicyclopropylmethyl)-3-phenylpropanamide;hydrochloride
CID 119277305
N-cyclohexyl-2-[(2,2-diphenylacetyl)amino]-3-phenylpropanamide
CID 3523242
(2S)-2-[[(2S)-2-amino-2-cyclohexylacetyl]amino]-3-phenylpropanamide
CID 11067759

Frequently Asked Questions

What is the IUPAC name of 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide?
The IUPAC name of 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide (CID 155014131) is 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide.
What is the SMILES notation for 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide?
The canonical SMILES for 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide is O=C(NO)C(Cc1ccccc1)C1CCCC2CCCCCCCC2C1.
What is the InChIKey of 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide?
The InChIKey is KZILASPQNYMVSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35NO2/c25-23(24-26)22(16-18-10-5-4-6-11-18)21-15-9-14-19-12-7-2-1-3-8-13-20(19)17-21/h4-6,10-11,19-22,26H,1-3,7-9,12-17H2,(H,24,25).
What are the key properties of 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide?
2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide has a molecular weight of 357.54 g/mol, XLogP of 5.52, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(11-bicyclo[7.5.0]tetradecanyl)-N-hydroxy-3-phenylpropanamide is sourced from PubChem (CID 155014131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).