(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide

C14H15NO3 — CID 92850098

IUPAC(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NO)ccc2c1
InChIInChI=1S/C14H15NO3/c1-9(14(16)15-17)10-3-4-12-8-13(18-2)6-5-11(12)7-10/h3-9,17H,1-2H3,(H,15,16)/t9-/m0/s1
InChIKeyRZCRNJWKSQLYQS-VIFPVBQESA-N
MW245.28 g/mol
LogP2.46
Rot. Bonds3

About (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide

(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide (PubChem CID 92850098) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
PubChem CID92850098
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NO)ccc2c1
InChIInChI=1S/C14H15NO3/c1-9(14(16)15-17)10-3-4-12-8-13(18-2)6-5-11(12)7-10/h3-9,17H,1-2H3,(H,15,16)/t9-/m0/s1
InChIKeyRZCRNJWKSQLYQS-VIFPVBQESA-N
XLogP2.46
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.46
H-Bond Donors ≤ 52
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

(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 110901591
3-(6-methoxynaphthalen-2-yl)butan-2-one
CID 13292512
(2S)-N-(2-methoxyethyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9207324
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(2S)-pentan-2-yl]propanamide
CID 95247403
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(1S)-1-(4-methoxyphenyl)propyl]propanamide
CID 39951625
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(1R)-1-(4-methoxyphenyl)propyl]propanamide
CID 39951624
sodium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 173070735
magnesium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 174047871
potassium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 174215246
(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid
CID 93477602
N-[(2S)-1-aminopropan-2-yl]-2-(6-methoxynaphthalen-2-yl)propanamide;hydrochloride
CID 120507302
(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-methylbutan-2-yl)propanamide
CID 54790218

Frequently Asked Questions

What is the IUPAC name of (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide?
The IUPAC name of (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide (CID 92850098) is (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide.
What is the SMILES notation for (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide?
The canonical SMILES for (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide is COc1ccc2cc([C@H](C)C(=O)NO)ccc2c1.
What is the InChIKey of (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide?
The InChIKey is RZCRNJWKSQLYQS-VIFPVBQESA-N. The full InChI is InChI=1S/C14H15NO3/c1-9(14(16)15-17)10-3-4-12-8-13(18-2)6-5-11(12)7-10/h3-9,17H,1-2H3,(H,15,16)/t9-/m0/s1.
What are the key properties of (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide?
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide has a molecular weight of 245.28 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide is sourced from PubChem (CID 92850098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).