N-[3-(dimethylamino)propyl]hydroxylamine

C5H14N2O — CID 17933586

IUPACN-[3-(dimethylamino)propyl]hydroxylamine
SMILESCN(C)CCCNO
InChIInChI=1S/C5H14N2O/c1-7(2)5-3-4-6-8/h6,8H,3-5H2,1-2H3
InChIKeyVUWLVIZBGMHAOC-UHFFFAOYSA-N
MW118.18 g/mol
LogP-0.30
Rot. Bonds4

About N-[3-(dimethylamino)propyl]hydroxylamine

N-[3-(dimethylamino)propyl]hydroxylamine (PubChem CID 17933586) has the molecular formula C5H14N2O and a molecular weight of 118.18 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]hydroxylamine.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]hydroxylamine
PubChem CID17933586
Molecular FormulaC5H14N2O
Molecular Weight118.18 g/mol
Exact Mass118.11
IUPAC NameN-[3-(dimethylamino)propyl]hydroxylamine
SMILESCN(C)CCCNO
InChIInChI=1S/C5H14N2O/c1-7(2)5-3-4-6-8/h6,8H,3-5H2,1-2H3
InChIKeyVUWLVIZBGMHAOC-UHFFFAOYSA-N
XLogP-0.30
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity47

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-Amino-N,N-dimethylpropan-1-amine N-oxide
CID 54151234
N~1~-Methoxy-N~1~-methylpropane-1,3-diamine
CID 14975839
N-(3-aminopropyl)-N-propylhydroxylamine
CID 20527030
N-(3-aminopropyl)-N-ethylhydroxylamine
CID 20527046
N-methoxy-N',N'-dimethylpropane-1,3-diamine
CID 21364272
1-amino-N,N-dimethylpropan-1-amine oxide
CID 21862924
3-Aminopropyl-ethyl-dihydroxyazanium
CID 22712849
N,N-bis(3-aminopropyl)hydroxylamine
CID 23382955
N-(3-aminopropyl)-N-methylhydroxylamine
CID 54496497
N-[3-(methylamino)propyl]hydroxylamine
CID 57304791
3-amino-N,N-diethylpropan-1-amine oxide
CID 59660217
3-amino-N-(3-aminopropyl)-N-methylpropan-1-amine oxide
CID 59660222

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]hydroxylamine?
The IUPAC name of N-[3-(dimethylamino)propyl]hydroxylamine (CID 17933586) is N-[3-(dimethylamino)propyl]hydroxylamine.
What is the SMILES notation for N-[3-(dimethylamino)propyl]hydroxylamine?
The canonical SMILES for N-[3-(dimethylamino)propyl]hydroxylamine is CN(C)CCCNO.
What is the InChIKey of N-[3-(dimethylamino)propyl]hydroxylamine?
The InChIKey is VUWLVIZBGMHAOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2O/c1-7(2)5-3-4-6-8/h6,8H,3-5H2,1-2H3.
What are the key properties of N-[3-(dimethylamino)propyl]hydroxylamine?
N-[3-(dimethylamino)propyl]hydroxylamine has a molecular weight of 118.18 g/mol, XLogP of -0.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]hydroxylamine is sourced from PubChem (CID 17933586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).