N-butylhydroxylamine;N-propylhydroxylamine

C7H20N2O2 — CID 18424001

IUPACN-butylhydroxylamine;N-propylhydroxylamine
SMILESCCCCNO.CCCNO
InChIInChI=1S/C4H11NO.C3H9NO/c1-2-3-4-5-6;1-2-3-4-5/h5-6H,2-4H2,1H3;4-5H,2-3H2,1H3
InChIKeyVLOQRMWACQTROX-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.14
Rot. Bonds5

About N-butylhydroxylamine;N-propylhydroxylamine

N-butylhydroxylamine;N-propylhydroxylamine (PubChem CID 18424001) has the molecular formula C7H20N2O2 and a molecular weight of 164.25 g/mol. Its IUPAC name is N-butylhydroxylamine;N-propylhydroxylamine.

Molecular Properties

Compound NameN-butylhydroxylamine;N-propylhydroxylamine
PubChem CID18424001
Molecular FormulaC7H20N2O2
Molecular Weight164.25 g/mol
Exact Mass164.15
IUPAC NameN-butylhydroxylamine;N-propylhydroxylamine
SMILESCCCCNO.CCCNO
InChIInChI=1S/C4H11NO.C3H9NO/c1-2-3-4-5-6;1-2-3-4-5/h5-6H,2-4H2,1H3;4-5H,2-3H2,1H3
InChIKeyVLOQRMWACQTROX-UHFFFAOYSA-N
XLogP1.14
TPSA64.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.14
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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

N-butylhydroxylamine hydrochloride
CID 12355440
N-hydroxyputrescine(1+)
CID 91820388
N-hydroxyputrescine
CID 24883439
N-Hydroxy-1-butanamine
CID 10034579
N~1~,N~4~-Dihydroxybutane-1,4-diamine
CID 20567327
N-hydroxy-diaminobutane
CID 101625038
Ethylamino titanate
CID 129676893
Tetramethyleneammoniumhydroxide
CID 129730631
ethane;N-propylhydroxylamine
CID 17807311
Butylaminooxyboronic acid
CID 17972426
Tris(butylamino) borate
CID 18764248
N-(butylaminooxy)butan-1-amine
CID 19356141

Frequently Asked Questions

What is the IUPAC name of N-butylhydroxylamine;N-propylhydroxylamine?
The IUPAC name of N-butylhydroxylamine;N-propylhydroxylamine (CID 18424001) is N-butylhydroxylamine;N-propylhydroxylamine.
What is the SMILES notation for N-butylhydroxylamine;N-propylhydroxylamine?
The canonical SMILES for N-butylhydroxylamine;N-propylhydroxylamine is CCCCNO.CCCNO.
What is the InChIKey of N-butylhydroxylamine;N-propylhydroxylamine?
The InChIKey is VLOQRMWACQTROX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO.C3H9NO/c1-2-3-4-5-6;1-2-3-4-5/h5-6H,2-4H2,1H3;4-5H,2-3H2,1H3.
What are the key properties of N-butylhydroxylamine;N-propylhydroxylamine?
N-butylhydroxylamine;N-propylhydroxylamine has a molecular weight of 164.25 g/mol, XLogP of 1.14, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butylhydroxylamine;N-propylhydroxylamine is sourced from PubChem (CID 18424001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).