O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine

C7H16N2O — CID 117126766

IUPACO-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine
SMILESCC(C)N1CCCC1ON
InChIInChI=1S/C7H16N2O/c1-6(2)9-5-3-4-7(9)10-8/h6-7H,3-5,8H2,1-2H3
InChIKeyAPTBWFHVLYXYOH-UHFFFAOYSA-N
MW144.22 g/mol
LogP0.71
Rot. Bonds2

About O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine

O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine (PubChem CID 117126766) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine.

Molecular Properties

Compound NameO-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine
PubChem CID117126766
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC NameO-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine
SMILESCC(C)N1CCCC1ON
InChIInChI=1S/C7H16N2O/c1-6(2)9-5-3-4-7(9)10-8/h6-7H,3-5,8H2,1-2H3
InChIKeyAPTBWFHVLYXYOH-UHFFFAOYSA-N
XLogP0.71
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

O-(1-pyrrolidin-1-ylethyl)hydroxylamine
CID 20381850
2-Methoxy-1-propan-2-ylpyrrolidine
CID 59556509
1,2-dimethylpyrrolidine;O-ethylhydroxylamine
CID 170571763
O-[(1-ethylpyrrolidin-3-yl)methyl]hydroxylamine
CID 84107101
O-[(1-propan-2-ylpyrrolidin-3-yl)methyl]hydroxylamine
CID 84107735
O-[(1-butan-2-ylpyrrolidin-3-yl)methyl]hydroxylamine
CID 84109263
N-(1-ethylpyrrolidin-2-yl)oxymethanamine
CID 117126718
N-(1-propan-2-ylpyrrolidin-2-yl)oxymethanamine
CID 117126719
O-(1-methylpyrrolidin-2-yl)hydroxylamine
CID 117126764
O-(1-ethylpyrrolidin-2-yl)hydroxylamine
CID 117126765
O-[4-(pyrrolidin-1-yl)butyl]hydroxylamine
CID 117126912
N-(4-pyrrolidin-1-ylbutoxy)methanamine
CID 117126913

Frequently Asked Questions

What is the IUPAC name of O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine?
The IUPAC name of O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine (CID 117126766) is O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine.
What is the SMILES notation for O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine?
The canonical SMILES for O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine is CC(C)N1CCCC1ON.
What is the InChIKey of O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine?
The InChIKey is APTBWFHVLYXYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-6(2)9-5-3-4-7(9)10-8/h6-7H,3-5,8H2,1-2H3.
What are the key properties of O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine?
O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine has a molecular weight of 144.22 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(1-propan-2-ylpyrrolidin-2-yl)hydroxylamine is sourced from PubChem (CID 117126766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).