N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide

C25H28N2O2 — CID 42624000

IUPACN-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide
SMILESC[C@@H](NC1CCCC(c2ccc(C(=O)NO)cc2)C1)c1cccc2ccccc12
InChIInChI=1S/C25H28N2O2/c1-17(23-11-5-7-19-6-2-3-10-24(19)23)26-22-9-4-8-21(16-22)18-12-14-20(15-13-18)25(28)27-29/h2-3,5-7,10-15,17,21-22,26,29H,4,8-9,16H2,1H3,(H,27,28)/t17-,21?,22?/m1/s1
InChIKeyRPTKEIDDDSXLCI-PPNDLDFTSA-N
MW388.51 g/mol
LogP5.34
Rot. Bonds5

About N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide

N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide (PubChem CID 42624000) has the molecular formula C25H28N2O2 and a molecular weight of 388.51 g/mol. Its IUPAC name is N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide
PubChem CID42624000
Molecular FormulaC25H28N2O2
Molecular Weight388.51 g/mol
Exact Mass388.22
IUPAC NameN-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide
SMILESC[C@@H](NC1CCCC(c2ccc(C(=O)NO)cc2)C1)c1cccc2ccccc12
InChIInChI=1S/C25H28N2O2/c1-17(23-11-5-7-19-6-2-3-10-24(19)23)26-22-9-4-8-21(16-22)18-12-14-20(15-13-18)25(28)27-29/h2-3,5-7,10-15,17,21-22,26,29H,4,8-9,16H2,1H3,(H,27,28)/t17-,21?,22?/m1/s1
InChIKeyRPTKEIDDDSXLCI-PPNDLDFTSA-N
XLogP5.34
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.51
LogP ≤ 55.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

N-methyl-4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide
CID 141396256
4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]-N-(2-sulfanylethyl)benzamide
CID 42623590
N-[(2-methylpropan-2-yl)oxy]-4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide
CID 59617218
2-[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]phenyl]acetic acid
CID 59617292
N-[4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cycloheptyl]phenyl]acetamide
CID 59617302
[4-[(1S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]phenyl]methanol
CID 42624182
3-(4-iodophenyl)-N-(1-naphthalen-1-ylethyl)cyclohexan-1-amine
CID 68779176
4-[3-(1-naphthalen-1-ylethylamino)cyclopentyl]benzoic acid
CID 68781148
4-[(1S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclopentyl]benzoic acid
CID 59617339
ethyl 1-[[4-[(1S,3S)-3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzoyl]amino]cyclopropane-1-carboxylate
CID 59617388
5-[[4-[3-(1-naphthalen-1-ylethylamino)cyclohexyl]benzoyl]amino]pyridine-3-carboxylic acid
CID 71016043
tert-butyl 3-hydroxy-2-[[4-[(1S,3S)-3-(1-naphthalen-1-ylethylamino)cyclohexyl]benzoyl]amino]propanoate
CID 68778639

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide?
The IUPAC name of N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide (CID 42624000) is N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide?
The canonical SMILES for N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide is C[C@@H](NC1CCCC(c2ccc(C(=O)NO)cc2)C1)c1cccc2ccccc12.
What is the InChIKey of N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide?
The InChIKey is RPTKEIDDDSXLCI-PPNDLDFTSA-N. The full InChI is InChI=1S/C25H28N2O2/c1-17(23-11-5-7-19-6-2-3-10-24(19)23)26-22-9-4-8-21(16-22)18-12-14-20(15-13-18)25(28)27-29/h2-3,5-7,10-15,17,21-22,26,29H,4,8-9,16H2,1H3,(H,27,28)/t17-,21?,22?/m1/s1.
What are the key properties of N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide?
N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide has a molecular weight of 388.51 g/mol, XLogP of 5.34, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[3-[[(1R)-1-naphthalen-1-ylethyl]amino]cyclohexyl]benzamide is sourced from PubChem (CID 42624000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).