N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine

C5H14N2O — CID 55299129

IUPACN-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine
SMILESCNCC(C)N(C)O
InChIInChI=1S/C5H14N2O/c1-5(4-6-2)7(3)8/h5-6,8H,4H2,1-3H3
InChIKeyHGIFHSMSQJCCJR-UHFFFAOYSA-N
MW118.18 g/mol
LogP-0.08
Rot. Bonds3

About N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine

N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine (PubChem CID 55299129) has the molecular formula C5H14N2O and a molecular weight of 118.18 g/mol. Its IUPAC name is N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine
PubChem CID55299129
Molecular FormulaC5H14N2O
Molecular Weight118.18 g/mol
Exact Mass118.11
IUPAC NameN-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine
SMILESCNCC(C)N(C)O
InChIInChI=1S/C5H14N2O/c1-5(4-6-2)7(3)8/h5-6,8H,4H2,1-3H3
InChIKeyHGIFHSMSQJCCJR-UHFFFAOYSA-N
XLogP-0.08
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine?
The IUPAC name of N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine (CID 55299129) is N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine.
What is the SMILES notation for N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine?
The canonical SMILES for N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine is CNCC(C)N(C)O.
What is the InChIKey of N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine?
The InChIKey is HGIFHSMSQJCCJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O/c1-5(4-6-2)7(3)8/h5-6,8H,4H2,1-3H3.
What are the key properties of N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine?
N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine has a molecular weight of 118.18 g/mol, XLogP of -0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(methylamino)propan-2-yl]hydroxylamine is sourced from PubChem (CID 55299129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).