azane;propan-2-ol;hydrochloride

C3H12ClNO — CID 88500405

IUPACazane;propan-2-ol;hydrochloride
SMILESCC(C)O.Cl.N
InChIInChI=1S/C3H8O.ClH.H3N/c1-3(2)4;;/h3-4H,1-2H3;1H;1H3
InChIKeyOZMCWWGXJZFBLQ-UHFFFAOYSA-N
MW113.59 g/mol
LogP0.97
Rot. Bonds

About azane;propan-2-ol;hydrochloride

azane;propan-2-ol;hydrochloride (PubChem CID 88500405) has the molecular formula C3H12ClNO and a molecular weight of 113.59 g/mol. Its IUPAC name is azane;propan-2-ol;hydrochloride.

Molecular Properties

Compound Nameazane;propan-2-ol;hydrochloride
PubChem CID88500405
Molecular FormulaC3H12ClNO
Molecular Weight113.59 g/mol
Exact Mass113.06
IUPAC Nameazane;propan-2-ol;hydrochloride
SMILESCC(C)O.Cl.N
InChIInChI=1S/C3H8O.ClH.H3N/c1-3(2)4;;/h3-4H,1-2H3;1H;1H3
InChIKeyOZMCWWGXJZFBLQ-UHFFFAOYSA-N
XLogP0.97
TPSA55.23 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.59
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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propan-2-ol;dihydrate;trihydrochloride
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erbium;propan-2-ol
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CID 85354423
CID 85354423
CID 131857540
CID 131857540
propan-2-ol;titanium
CID 25200171
ethane;tetrakis(propan-2-ol)
CID 174681393
cerium;tetrakis(propan-2-ol)
CID 87109563
methanol;pentakis(propan-2-ol)
CID 19010899

Frequently Asked Questions

What is the IUPAC name of azane;propan-2-ol;hydrochloride?
The IUPAC name of azane;propan-2-ol;hydrochloride (CID 88500405) is azane;propan-2-ol;hydrochloride.
What is the SMILES notation for azane;propan-2-ol;hydrochloride?
The canonical SMILES for azane;propan-2-ol;hydrochloride is CC(C)O.Cl.N.
What is the InChIKey of azane;propan-2-ol;hydrochloride?
The InChIKey is OZMCWWGXJZFBLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O.ClH.H3N/c1-3(2)4;;/h3-4H,1-2H3;1H;1H3.
What are the key properties of azane;propan-2-ol;hydrochloride?
azane;propan-2-ol;hydrochloride has a molecular weight of 113.59 g/mol, XLogP of 0.97, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;propan-2-ol;hydrochloride is sourced from PubChem (CID 88500405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).