methanamine;pentahydrate

CH15NO5 — CID 172744028

IUPACmethanamine;pentahydrate
SMILESCN.O.O.O.O.O
InChIInChI=1S/CH5N.5H2O/c1-2;;;;;/h2H2,1H3;5*1H2
InChIKeyJMBSNGOPQDZCLC-UHFFFAOYSA-N
MW121.13 g/mol
LogP-4.55
Rot. Bonds

About methanamine;pentahydrate

methanamine;pentahydrate (PubChem CID 172744028) has the molecular formula CH15NO5 and a molecular weight of 121.13 g/mol. Its IUPAC name is methanamine;pentahydrate.

Molecular Properties

Compound Namemethanamine;pentahydrate
PubChem CID172744028
Molecular FormulaCH15NO5
Molecular Weight121.13 g/mol
Exact Mass121.10
IUPAC Namemethanamine;pentahydrate
SMILESCN.O.O.O.O.O
InChIInChI=1S/CH5N.5H2O/c1-2;;;;;/h2H2,1H3;5*1H2
InChIKeyJMBSNGOPQDZCLC-UHFFFAOYSA-N
XLogP-4.55
TPSA183.52 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.13
LogP ≤ 5-4.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

calcium;hydride;methanamine;hydrate
CID 174963737
ethene;methanamine;hydrate
CID 172680879
ethane;methanamine
CID 170584679
methanamine;hydrochloride
CID 175763103
methanamine;tetrahydrofluoride
CID 173208166
methanamine;hydrochloride;hydroiodide
CID 175926023
methanamine;palladium(2+);chloride
CID 23346710
methanamine;molecular iodine
CID 159259076
CID 174787228
CID 174787228
potassium;hydride;methanamine
CID 173303983
methanamine;bis(oxygen(2-));titanium(4+)
CID 173296281
acetylene;methanamine
CID 158114414

Frequently Asked Questions

What is the IUPAC name of methanamine;pentahydrate?
The IUPAC name of methanamine;pentahydrate (CID 172744028) is methanamine;pentahydrate.
What is the SMILES notation for methanamine;pentahydrate?
The canonical SMILES for methanamine;pentahydrate is CN.O.O.O.O.O.
What is the InChIKey of methanamine;pentahydrate?
The InChIKey is JMBSNGOPQDZCLC-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5N.5H2O/c1-2;;;;;/h2H2,1H3;5*1H2.
What are the key properties of methanamine;pentahydrate?
methanamine;pentahydrate has a molecular weight of 121.13 g/mol, XLogP of -4.55, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;pentahydrate is sourced from PubChem (CID 172744028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).