N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide

C16H20N2O2 — CID 58982133

IUPACN-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide
SMILESCN(CCCC(=O)NO)Cc1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-18(10-4-7-16(19)17-20)12-13-8-9-14-5-2-3-6-15(14)11-13/h2-3,5-6,8-9,11,20H,4,7,10,12H2,1H3,(H,17,19)
InChIKeyRUYXKGPCBFHUMJ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.56
Rot. Bonds6

About N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide

N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide (PubChem CID 58982133) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide.

Molecular Properties

Compound NameN-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide
PubChem CID58982133
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide
SMILESCN(CCCC(=O)NO)Cc1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O2/c1-18(10-4-7-16(19)17-20)12-13-8-9-14-5-2-3-6-15(14)11-13/h2-3,5-6,8-9,11,20H,4,7,10,12H2,1H3,(H,17,19)
InChIKeyRUYXKGPCBFHUMJ-UHFFFAOYSA-N
XLogP2.56
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.56
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

4-[methyl(naphthalen-2-ylmethyl)amino]butane-1-sulfonic acid
CID 8599863
1-N-methyl-1-N-(naphthalen-2-ylmethyl)butane-1,3-diamine
CID 115199470
N-methyl-N-(naphthalen-2-ylmethyl)-1-phenylmethanamine
CID 44767910
2-[methyl(naphthalen-2-ylmethyl)amino]-N-(2-phenylethyl)acetamide
CID 9261639
N-[(4-fluorophenyl)methyl]-N-methyl-2-[methyl(naphthalen-2-ylmethyl)amino]acetamide
CID 27073013
2-[methyl(naphthalen-2-ylmethyl)amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 9261630
N-methyl-N-(naphthalen-2-ylmethyl)prop-2-enamide
CID 54874632
1-N,3-dimethyl-1-N-(naphthalen-2-ylmethyl)butane-1,3-diamine
CID 115200753
2-bromo-N,2-dimethyl-N-(naphthalen-2-ylmethyl)propanamide
CID 114328072
N-hydroxy-2-[naphthalen-2-ylmethyl(octylsulfonyl)amino]acetamide
CID 18325178
3-ethyl-1-methyl-1-(naphthalen-2-ylmethyl)urea
CID 34711127
N-methyl-4-naphthalen-2-ylbutanehydrazide
CID 116845183

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide?
The IUPAC name of N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide (CID 58982133) is N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide.
What is the SMILES notation for N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide?
The canonical SMILES for N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide is CN(CCCC(=O)NO)Cc1ccc2ccccc2c1.
What is the InChIKey of N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide?
The InChIKey is RUYXKGPCBFHUMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-18(10-4-7-16(19)17-20)12-13-8-9-14-5-2-3-6-15(14)11-13/h2-3,5-6,8-9,11,20H,4,7,10,12H2,1H3,(H,17,19).
What are the key properties of N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide?
N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide has a molecular weight of 272.35 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[methyl(naphthalen-2-ylmethyl)amino]butanamide is sourced from PubChem (CID 58982133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).