N-methyl-1-methylphosphanylethanamine

C4H12NP — CID 144537771

IUPACN-methyl-1-methylphosphanylethanamine
SMILESCNC(C)PC
InChIInChI=1S/C4H12NP/c1-4(5-2)6-3/h4-6H,1-3H3
InChIKeyMCDCBSRWIMWQLG-UHFFFAOYSA-N
MW105.12 g/mol
LogP0.86
Rot. Bonds2

About N-methyl-1-methylphosphanylethanamine

N-methyl-1-methylphosphanylethanamine (PubChem CID 144537771) has the molecular formula C4H12NP and a molecular weight of 105.12 g/mol. Its IUPAC name is N-methyl-1-methylphosphanylethanamine.

Molecular Properties

Compound NameN-methyl-1-methylphosphanylethanamine
PubChem CID144537771
Molecular FormulaC4H12NP
Molecular Weight105.12 g/mol
Exact Mass105.07
IUPAC NameN-methyl-1-methylphosphanylethanamine
SMILESCNC(C)PC
InChIInChI=1S/C4H12NP/c1-4(5-2)6-3/h4-6H,1-3H3
InChIKeyMCDCBSRWIMWQLG-UHFFFAOYSA-N
XLogP0.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.12
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-methylphosphanylethanamine?
The IUPAC name of N-methyl-1-methylphosphanylethanamine (CID 144537771) is N-methyl-1-methylphosphanylethanamine.
What is the SMILES notation for N-methyl-1-methylphosphanylethanamine?
The canonical SMILES for N-methyl-1-methylphosphanylethanamine is CNC(C)PC.
What is the InChIKey of N-methyl-1-methylphosphanylethanamine?
The InChIKey is MCDCBSRWIMWQLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12NP/c1-4(5-2)6-3/h4-6H,1-3H3.
What are the key properties of N-methyl-1-methylphosphanylethanamine?
N-methyl-1-methylphosphanylethanamine has a molecular weight of 105.12 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-methylphosphanylethanamine is sourced from PubChem (CID 144537771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).