1-hydrazinyl-3-prop-2-enoxypropan-2-ol

C6H14N2O2 — CID 130123997

IUPAC1-hydrazinyl-3-prop-2-enoxypropan-2-ol
SMILESC=CCOCC(O)CNN
InChIInChI=1S/C6H14N2O2/c1-2-3-10-5-6(9)4-8-7/h2,6,8-9H,1,3-5,7H2
InChIKeyKLVRHQLJROZKCT-UHFFFAOYSA-N
MW146.19 g/mol
LogP-0.99
Rot. Bonds6

About 1-hydrazinyl-3-prop-2-enoxypropan-2-ol

1-hydrazinyl-3-prop-2-enoxypropan-2-ol (PubChem CID 130123997) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 1-hydrazinyl-3-prop-2-enoxypropan-2-ol.

Molecular Properties

Compound Name1-hydrazinyl-3-prop-2-enoxypropan-2-ol
PubChem CID130123997
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name1-hydrazinyl-3-prop-2-enoxypropan-2-ol
SMILESC=CCOCC(O)CNN
InChIInChI=1S/C6H14N2O2/c1-2-3-10-5-6(9)4-8-7/h2,6,8-9H,1,3-5,7H2
InChIKeyKLVRHQLJROZKCT-UHFFFAOYSA-N
XLogP-0.99
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 154701098
CID 154701098
methane;3-prop-2-enoxypropane-1,2-diol
CID 174709121
(2S)-1-prop-2-enoxy-3-(2,4,4-trimethylpentan-2-ylamino)propan-2-ol
CID 41300677
1-prop-2-enoxyhex-5-en-2-ol
CID 12963723
3-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]propane-1,2-diol
CID 54120900
1-ethoxy-3-prop-2-enoxypropan-2-ol
CID 10953806
1-ethoxy-3-[2-hydroxy-3-(2-hydroxy-3-prop-2-enoxypropoxy)propoxy]propan-2-ol
CID 172513845
(2S)-1-(benzylamino)-3-prop-2-enoxypropan-2-ol
CID 34178559
1-(dimethylamino)-3-prop-2-enoxypropan-2-ol;hydrochloride
CID 3022344
2-(2-hydroxy-3-prop-2-enoxypropoxy)propane-1,3-diol
CID 129166429
bis(2-hydroxy-3-prop-2-enoxypropyl) sulfate
CID 174573548
(2R)-1-[4-[(2S)-2-hydroxy-3-prop-2-enoxypropyl]piperazine-1,4-diium-1-yl]-3-prop-2-enoxypropan-2-ol
CID 7590532

Frequently Asked Questions

What is the IUPAC name of 1-hydrazinyl-3-prop-2-enoxypropan-2-ol?
The IUPAC name of 1-hydrazinyl-3-prop-2-enoxypropan-2-ol (CID 130123997) is 1-hydrazinyl-3-prop-2-enoxypropan-2-ol.
What is the SMILES notation for 1-hydrazinyl-3-prop-2-enoxypropan-2-ol?
The canonical SMILES for 1-hydrazinyl-3-prop-2-enoxypropan-2-ol is C=CCOCC(O)CNN.
What is the InChIKey of 1-hydrazinyl-3-prop-2-enoxypropan-2-ol?
The InChIKey is KLVRHQLJROZKCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-2-3-10-5-6(9)4-8-7/h2,6,8-9H,1,3-5,7H2.
What are the key properties of 1-hydrazinyl-3-prop-2-enoxypropan-2-ol?
1-hydrazinyl-3-prop-2-enoxypropan-2-ol has a molecular weight of 146.19 g/mol, XLogP of -0.99, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydrazinyl-3-prop-2-enoxypropan-2-ol is sourced from PubChem (CID 130123997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).