N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine

C9H22NO3P — CID 170850998

IUPACN-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine
SMILESCCCOP(=O)(OCC)N(C)C(C)C
InChIInChI=1S/C9H22NO3P/c1-6-8-13-14(11,12-7-2)10(5)9(3)4/h9H,6-8H2,1-5H3
InChIKeyKOORIHDMAXPPPU-UHFFFAOYSA-N
MW223.25 g/mol
LogP2.90
Rot. Bonds7

About N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine

N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine (PubChem CID 170850998) has the molecular formula C9H22NO3P and a molecular weight of 223.25 g/mol. Its IUPAC name is N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine
PubChem CID170850998
Molecular FormulaC9H22NO3P
Molecular Weight223.25 g/mol
Exact Mass223.13
IUPAC NameN-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine
SMILESCCCOP(=O)(OCC)N(C)C(C)C
InChIInChI=1S/C9H22NO3P/c1-6-8-13-14(11,12-7-2)10(5)9(3)4/h9H,6-8H2,1-5H3
InChIKeyKOORIHDMAXPPPU-UHFFFAOYSA-N
XLogP2.90
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-dimethoxyphosphoryl-N-methylpropan-2-amine
CID 14339947
N-[methoxy(propoxy)phosphoryl]-N-methylmethanamine
CID 541932
1-diethoxyphosphoryl-1-methylhydrazine
CID 10773763
1-diethoxyphosphoryl-1-(1-diethoxyphosphorylethyldisulfanyl)ethane
CID 12536435
2-[diethoxyphosphoryl(methyl)amino]-1-phenylpropan-1-ol
CID 66624386
N-dipropoxyphosphoryl-N-ethylpropan-1-amine
CID 24741650
N-[methoxy(propan-2-yloxy)phosphoryl]-N-methylpropan-2-amine
CID 58400114
N-[[diethoxyphosphoryl(methyl)amino]-(dimethylamino)phosphanyl]-N-methylmethanamine
CID 23272902
propyl phosphate;bis(tetramethylphosphanium)
CID 87474534
2-diethoxyphosphorylbutane
CID 2733649
1-deuterio-1-diethoxyphosphoryl-1-fluoroethane
CID 10910232
1-diethoxyphosphorylethanamine
CID 5149858

Frequently Asked Questions

What is the IUPAC name of N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine?
The IUPAC name of N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine (CID 170850998) is N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine?
The canonical SMILES for N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine is CCCOP(=O)(OCC)N(C)C(C)C.
What is the InChIKey of N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine?
The InChIKey is KOORIHDMAXPPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NO3P/c1-6-8-13-14(11,12-7-2)10(5)9(3)4/h9H,6-8H2,1-5H3.
What are the key properties of N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine?
N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine has a molecular weight of 223.25 g/mol, XLogP of 2.90, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethoxy(propoxy)phosphoryl]-N-methylpropan-2-amine is sourced from PubChem (CID 170850998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).