N-(3-methylbutan-2-yl)hydroxylamine

C5H13NO — CID 19073521

IUPACN-(3-methylbutan-2-yl)hydroxylamine
SMILESCC(C)C(C)NO
InChIInChI=1S/C5H13NO/c1-4(2)5(3)6-7/h4-7H,1-3H3
InChIKeyYPORECDPLSEMDE-UHFFFAOYSA-N
MW103.17 g/mol
LogP1.01
Rot. Bonds2

About N-(3-methylbutan-2-yl)hydroxylamine

N-(3-methylbutan-2-yl)hydroxylamine (PubChem CID 19073521) has the molecular formula C5H13NO and a molecular weight of 103.17 g/mol. Its IUPAC name is N-(3-methylbutan-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-(3-methylbutan-2-yl)hydroxylamine
PubChem CID19073521
Molecular FormulaC5H13NO
Molecular Weight103.17 g/mol
Exact Mass103.10
IUPAC NameN-(3-methylbutan-2-yl)hydroxylamine
SMILESCC(C)C(C)NO
InChIInChI=1S/C5H13NO/c1-4(2)5(3)6-7/h4-7H,1-3H3
InChIKeyYPORECDPLSEMDE-UHFFFAOYSA-N
XLogP1.01
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Isopropylhydroxylamine
CID 78763
N-(2-methylpropyl)hydroxylamine
CID 9543329
1-Methylpropylhydroxyl amine
CID 3018801
N-(1-cyclopropylethyl)hydroxylamine
CID 10510818
N-(3,3-dimethylbutan-2-yl)hydroxylamine
CID 13579691
N-(pentan-3-yl)hydroxylamine
CID 19073513
Isobutylhydroxylamine hydrochloride
CID 21252766
N-methoxy-3-methylbutan-2-amine
CID 82711534
N-[(2R)-3-methylbutan-2-yl]hydroxylamine
CID 123857434
N-Hydroxy-sec-butylammonium chloride
CID 12355451
N-(1,1,1-trifluoro-3-methylbutan-2-yl)hydroxylamine
CID 170174185
N-(3-methylbutyl)hydroxylamine;hydrochloride
CID 24186101

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutan-2-yl)hydroxylamine?
The IUPAC name of N-(3-methylbutan-2-yl)hydroxylamine (CID 19073521) is N-(3-methylbutan-2-yl)hydroxylamine.
What is the SMILES notation for N-(3-methylbutan-2-yl)hydroxylamine?
The canonical SMILES for N-(3-methylbutan-2-yl)hydroxylamine is CC(C)C(C)NO.
What is the InChIKey of N-(3-methylbutan-2-yl)hydroxylamine?
The InChIKey is YPORECDPLSEMDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-4(2)5(3)6-7/h4-7H,1-3H3.
What are the key properties of N-(3-methylbutan-2-yl)hydroxylamine?
N-(3-methylbutan-2-yl)hydroxylamine has a molecular weight of 103.17 g/mol, XLogP of 1.01, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutan-2-yl)hydroxylamine is sourced from PubChem (CID 19073521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).