N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine

C9H20NO2P — CID 134342670

IUPACN-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine
SMILESC=CCOP(OCC)N(C)C(C)C
InChIInChI=1S/C9H20NO2P/c1-6-8-12-13(11-7-2)10(5)9(3)4/h6,9H,1,7-8H2,2-5H3
InChIKeyIUKHLPRXZLDNBF-UHFFFAOYSA-N
MW205.24 g/mol
LogP2.79
Rot. Bonds7

About N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine

N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine (PubChem CID 134342670) has the molecular formula C9H20NO2P and a molecular weight of 205.24 g/mol. Its IUPAC name is N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine
PubChem CID134342670
Molecular FormulaC9H20NO2P
Molecular Weight205.24 g/mol
Exact Mass205.12
IUPAC NameN-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine
SMILESC=CCOP(OCC)N(C)C(C)C
InChIInChI=1S/C9H20NO2P/c1-6-8-12-13(11-7-2)10(5)9(3)4/h6,9H,1,7-8H2,2-5H3
InChIKeyIUKHLPRXZLDNBF-UHFFFAOYSA-N
XLogP2.79
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[amino(prop-2-enoxy)phosphanyl]oxypropane
CID 174633536
bis(ethenyl)-ethoxyphosphane
CID 130251440
N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine
CID 14867282
3-(1-ethoxyethoxy)prop-1-ene;sulfuryl difluoride
CID 161465495
N,N-dimethylethanamine;ethyl prop-2-enyl sulfate
CID 87856591
N-diethoxyphosphanyl-N-diphenylphosphanylpropan-2-amine
CID 147294566
dimethyl-bis(1-prop-2-enoxyethyl)azanium
CID 87092032
(4R,5S)-4-[[[di(propan-2-yl)amino]-prop-2-enoxyphosphanyl]oxymethyl]-5-(hydroxymethyl)oxolan-2-one
CID 10711692
ethyl 2-[[methyl(propan-2-yl)sulfamoyl]-prop-2-enylamino]acetate
CID 78977560
bromoethene;diethyl hydrogen phosphite
CID 88780762
4-ethoxypent-1-ene
CID 12776575
(2S)-1-methoxy-N-methyl-N-prop-2-enylpropan-2-amine
CID 171624070

Frequently Asked Questions

What is the IUPAC name of N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine?
The IUPAC name of N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine (CID 134342670) is N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine.
What is the SMILES notation for N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine?
The canonical SMILES for N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine is C=CCOP(OCC)N(C)C(C)C.
What is the InChIKey of N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine?
The InChIKey is IUKHLPRXZLDNBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20NO2P/c1-6-8-12-13(11-7-2)10(5)9(3)4/h6,9H,1,7-8H2,2-5H3.
What are the key properties of N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine?
N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine has a molecular weight of 205.24 g/mol, XLogP of 2.79, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[ethoxy(prop-2-enoxy)phosphanyl]-N-methylpropan-2-amine is sourced from PubChem (CID 134342670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).