azane;octadecahydrate

H39NO18 — CID 174841699

IUPACazane;octadecahydrate
SMILESN.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O
InChIInChI=1S/H3N.18H2O/h1H3;18*1H2
InChIKeyOUWRWWARQSGSEK-UHFFFAOYSA-N
MW341.30 g/mol
LogP-14.68
Rot. Bonds

About azane;octadecahydrate

azane;octadecahydrate (PubChem CID 174841699) has the molecular formula H39NO18 and a molecular weight of 341.30 g/mol. Its IUPAC name is azane;octadecahydrate.

Molecular Properties

Compound Nameazane;octadecahydrate
PubChem CID174841699
Molecular FormulaH39NO18
Molecular Weight341.30 g/mol
Exact Mass341.22
IUPAC Nameazane;octadecahydrate
SMILESN.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O
InChIInChI=1S/H3N.18H2O/h1H3;18*1H2
InChIKeyOUWRWWARQSGSEK-UHFFFAOYSA-N
XLogP-14.68
TPSA602.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.30
LogP ≤ 5-14.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of azane;octadecahydrate?
The IUPAC name of azane;octadecahydrate (CID 174841699) is azane;octadecahydrate.
What is the SMILES notation for azane;octadecahydrate?
The canonical SMILES for azane;octadecahydrate is N.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.
What is the InChIKey of azane;octadecahydrate?
The InChIKey is OUWRWWARQSGSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N.18H2O/h1H3;18*1H2.
What are the key properties of azane;octadecahydrate?
azane;octadecahydrate has a molecular weight of 341.30 g/mol, XLogP of -14.68, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;octadecahydrate is sourced from PubChem (CID 174841699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).