N-pentan-3-ylhydroxylamine

C5H13NO — CID 19073513

IUPACN-pentan-3-ylhydroxylamine
SMILESCCC(CC)NO
InChIInChI=1S/C5H13NO/c1-3-5(4-2)6-7/h5-7H,3-4H2,1-2H3
InChIKeyNVEFQYHCCMKEOO-UHFFFAOYSA-N
MW103.17 g/mol
LogP1.15
Rot. Bonds3

About N-pentan-3-ylhydroxylamine

N-pentan-3-ylhydroxylamine (PubChem CID 19073513) has the molecular formula C5H13NO and a molecular weight of 103.17 g/mol. Its IUPAC name is N-pentan-3-ylhydroxylamine.

Molecular Properties

Compound NameN-pentan-3-ylhydroxylamine
PubChem CID19073513
Molecular FormulaC5H13NO
Molecular Weight103.17 g/mol
Exact Mass103.10
IUPAC NameN-pentan-3-ylhydroxylamine
SMILESCCC(CC)NO
InChIInChI=1S/C5H13NO/c1-3-5(4-2)6-7/h5-7H,3-4H2,1-2H3
InChIKeyNVEFQYHCCMKEOO-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.17
LogP ≤ 51.15
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-Isopropylhydroxylamine Hydrochloride
CID 170873
N-Hydroxy-1-butanamine
CID 10034579
Methoxy(propan-2-YL)amine
CID 12651820
1-Methylpropylhydroxyl amine
CID 3018801
N-pentylhydroxylamine
CID 9833936
N-heptan-4-ylhydroxylamine
CID 12385753
N-(3-methylbutan-2-yl)hydroxylamine
CID 19073521
Hydroxypropylenediamine
CID 22185305
N-[(2R)-3-methylbutan-2-yl]hydroxylamine
CID 123857434
N-Hydroxy-sec-butylammonium chloride
CID 12355451
Hydroxy(propan-2-yl)azanium chloride
CID 11355458

Frequently Asked Questions

What is the IUPAC name of N-pentan-3-ylhydroxylamine?
The IUPAC name of N-pentan-3-ylhydroxylamine (CID 19073513) is N-pentan-3-ylhydroxylamine.
What is the SMILES notation for N-pentan-3-ylhydroxylamine?
The canonical SMILES for N-pentan-3-ylhydroxylamine is CCC(CC)NO.
What is the InChIKey of N-pentan-3-ylhydroxylamine?
The InChIKey is NVEFQYHCCMKEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO/c1-3-5(4-2)6-7/h5-7H,3-4H2,1-2H3.
What are the key properties of N-pentan-3-ylhydroxylamine?
N-pentan-3-ylhydroxylamine has a molecular weight of 103.17 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-3-ylhydroxylamine is sourced from PubChem (CID 19073513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).