N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine

C7H18NOP — CID 147883645

IUPACN-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine
SMILESCCCN(C)CC(P)OC
InChIInChI=1S/C7H18NOP/c1-4-5-8(2)6-7(10)9-3/h7H,4-6,10H2,1-3H3
InChIKeyIAXJEQGDWNWTPP-UHFFFAOYSA-N
MW163.20 g/mol
LogP1.18
Rot. Bonds5

About N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine

N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine (PubChem CID 147883645) has the molecular formula C7H18NOP and a molecular weight of 163.20 g/mol. Its IUPAC name is N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine.

Molecular Properties

Compound NameN-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine
PubChem CID147883645
Molecular FormulaC7H18NOP
Molecular Weight163.20 g/mol
Exact Mass163.11
IUPAC NameN-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine
SMILESCCCN(C)CC(P)OC
InChIInChI=1S/C7H18NOP/c1-4-5-8(2)6-7(10)9-3/h7H,4-6,10H2,1-3H3
InChIKeyIAXJEQGDWNWTPP-UHFFFAOYSA-N
XLogP1.18
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.20
LogP ≤ 51.18
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-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine?
The IUPAC name of N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine (CID 147883645) is N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine.
What is the SMILES notation for N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine?
The canonical SMILES for N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine is CCCN(C)CC(P)OC.
What is the InChIKey of N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine?
The InChIKey is IAXJEQGDWNWTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18NOP/c1-4-5-8(2)6-7(10)9-3/h7H,4-6,10H2,1-3H3.
What are the key properties of N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine?
N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine has a molecular weight of 163.20 g/mol, XLogP of 1.18, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-2-phosphanylethyl)-N-methylpropan-1-amine is sourced from PubChem (CID 147883645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).