N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane

C10H26N3O2P — CID 86583969

IUPACN-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane
SMILESC1CCOC1.CN(C)P(=O)(N(C)C)N(C)C
InChIInChI=1S/C6H18N3OP.C4H8O/c1-7(2)11(10,8(3)4)9(5)6;1-2-4-5-3-1/h1-6H3;1-4H2
InChIKeyONDXXAPHPJPFKQ-UHFFFAOYSA-N
MW251.31 g/mol
LogP1.58
Rot. Bonds3

About N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane

N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane (PubChem CID 86583969) has the molecular formula C10H26N3O2P and a molecular weight of 251.31 g/mol. Its IUPAC name is N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane.

Molecular Properties

Compound NameN-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane
PubChem CID86583969
Molecular FormulaC10H26N3O2P
Molecular Weight251.31 g/mol
Exact Mass251.18
IUPAC NameN-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane
SMILESC1CCOC1.CN(C)P(=O)(N(C)C)N(C)C
InChIInChI=1S/C6H18N3OP.C4H8O/c1-7(2)11(10,8(3)4)9(5)6;1-2-4-5-3-1/h1-6H3;1-4H2
InChIKeyONDXXAPHPJPFKQ-UHFFFAOYSA-N
XLogP1.58
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane?
The IUPAC name of N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane (CID 86583969) is N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane.
What is the SMILES notation for N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane?
The canonical SMILES for N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane is C1CCOC1.CN(C)P(=O)(N(C)C)N(C)C.
What is the InChIKey of N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane?
The InChIKey is ONDXXAPHPJPFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H18N3OP.C4H8O/c1-7(2)11(10,8(3)4)9(5)6;1-2-4-5-3-1/h1-6H3;1-4H2.
What are the key properties of N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane?
N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane has a molecular weight of 251.31 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[bis(dimethylamino)phosphoryl]-N-methylmethanamine;oxolane is sourced from PubChem (CID 86583969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).