N-[2-(hydroxyamino)-2-methylpropyl]butanamide

C8H18N2O2 — CID 58654641

IUPACN-[2-(hydroxyamino)-2-methylpropyl]butanamide
SMILESCCCC(=O)NCC(C)(C)NO
InChIInChI=1S/C8H18N2O2/c1-4-5-7(11)9-6-8(2,3)10-12/h10,12H,4-6H2,1-3H3,(H,9,11)
InChIKeyLTLGKEVBTLLTNR-UHFFFAOYSA-N
MW174.24 g/mol
LogP0.66
Rot. Bonds5

About N-[2-(hydroxyamino)-2-methylpropyl]butanamide

N-[2-(hydroxyamino)-2-methylpropyl]butanamide (PubChem CID 58654641) has the molecular formula C8H18N2O2 and a molecular weight of 174.24 g/mol. Its IUPAC name is N-[2-(hydroxyamino)-2-methylpropyl]butanamide.

Molecular Properties

Compound NameN-[2-(hydroxyamino)-2-methylpropyl]butanamide
PubChem CID58654641
Molecular FormulaC8H18N2O2
Molecular Weight174.24 g/mol
Exact Mass174.14
IUPAC NameN-[2-(hydroxyamino)-2-methylpropyl]butanamide
SMILESCCCC(=O)NCC(C)(C)NO
InChIInChI=1S/C8H18N2O2/c1-4-5-7(11)9-6-8(2,3)10-12/h10,12H,4-6H2,1-3H3,(H,9,11)
InChIKeyLTLGKEVBTLLTNR-UHFFFAOYSA-N
XLogP0.66
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Cambridge id 5510952
CID 870734
N-[2-(butanoylamino)ethyl]butanamide
CID 280045
2-Ethyl-n-[2-(hydroxyamino)-2-oxoethyl]butanamide
CID 100703
(2R)-2-[(2-acetamidoacetyl)amino]-N-tert-butyl-N-hydroxypropanamide
CID 154721504
N-[2-methyl-2-(propanoylamino)butyl]propanamide
CID 71922860
N-[2-(butanoylamino)propyl]butanamide
CID 2932712
N-(2-t-butylaminoethyl)propionamide
CID 20543315
N-[(2R)-2-(butanoylamino)propyl]butanamide
CID 1744972
2-[2-aminopropanoyl(methyl)amino]-N-hydroxy-2-methylpropanamide
CID 18729338
N-(2-amino-2-methylpropyl)-3-methylbutanamide
CID 21530342
N-(2-acetamidoethyl)butanamide
CID 23523810
2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide
CID 23563826

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxyamino)-2-methylpropyl]butanamide?
The IUPAC name of N-[2-(hydroxyamino)-2-methylpropyl]butanamide (CID 58654641) is N-[2-(hydroxyamino)-2-methylpropyl]butanamide.
What is the SMILES notation for N-[2-(hydroxyamino)-2-methylpropyl]butanamide?
The canonical SMILES for N-[2-(hydroxyamino)-2-methylpropyl]butanamide is CCCC(=O)NCC(C)(C)NO.
What is the InChIKey of N-[2-(hydroxyamino)-2-methylpropyl]butanamide?
The InChIKey is LTLGKEVBTLLTNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2/c1-4-5-7(11)9-6-8(2,3)10-12/h10,12H,4-6H2,1-3H3,(H,9,11).
What are the key properties of N-[2-(hydroxyamino)-2-methylpropyl]butanamide?
N-[2-(hydroxyamino)-2-methylpropyl]butanamide has a molecular weight of 174.24 g/mol, XLogP of 0.66, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxyamino)-2-methylpropyl]butanamide is sourced from PubChem (CID 58654641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).