methanamine;1-phosphorosopentane

C8H26N3OP — CID 174435615

IUPACmethanamine;1-phosphorosopentane
SMILESCCCCCP=O.CN.CN.CN
InChIInChI=1S/C5H11OP.3CH5N/c1-2-3-4-5-7-6;3*1-2/h2-5H2,1H3;3*2H2,1H3
InChIKeyJARPUPDKFWMZOJ-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.19
Rot. Bonds4

About methanamine;1-phosphorosopentane

methanamine;1-phosphorosopentane (PubChem CID 174435615) has the molecular formula C8H26N3OP and a molecular weight of 211.29 g/mol. Its IUPAC name is methanamine;1-phosphorosopentane.

Molecular Properties

Compound Namemethanamine;1-phosphorosopentane
PubChem CID174435615
Molecular FormulaC8H26N3OP
Molecular Weight211.29 g/mol
Exact Mass211.18
IUPAC Namemethanamine;1-phosphorosopentane
SMILESCCCCCP=O.CN.CN.CN
InChIInChI=1S/C5H11OP.3CH5N/c1-2-3-4-5-7-6;3*1-2/h2-5H2,1H3;3*2H2,1H3
InChIKeyJARPUPDKFWMZOJ-UHFFFAOYSA-N
XLogP1.19
TPSA95.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1-phosphorosopentane;1,3,5-trimethylbenzene
CID 175057624
1-phosphorosopentane;1,3-xylene
CID 174843053
methanamine;tris(octane)
CID 173014836
decane;methanamine
CID 159574300
methanamine;octane
CID 174301406
methanamine;nonane
CID 155694820
hexane;phosphenous acid
CID 21406649
hexadecane;methanamine;hydrobromide
CID 175276433
heptadecane;hydrazine
CID 174880698
hexane;oxomercury
CID 174814256
hydrazine;pentadecane
CID 174880620
1-selenophosphorosotridecane
CID 87250093

Frequently Asked Questions

What is the IUPAC name of methanamine;1-phosphorosopentane?
The IUPAC name of methanamine;1-phosphorosopentane (CID 174435615) is methanamine;1-phosphorosopentane.
What is the SMILES notation for methanamine;1-phosphorosopentane?
The canonical SMILES for methanamine;1-phosphorosopentane is CCCCCP=O.CN.CN.CN.
What is the InChIKey of methanamine;1-phosphorosopentane?
The InChIKey is JARPUPDKFWMZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11OP.3CH5N/c1-2-3-4-5-7-6;3*1-2/h2-5H2,1H3;3*2H2,1H3.
What are the key properties of methanamine;1-phosphorosopentane?
methanamine;1-phosphorosopentane has a molecular weight of 211.29 g/mol, XLogP of 1.19, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;1-phosphorosopentane is sourced from PubChem (CID 174435615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).