N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine

C8H19ClNOP — CID 14867282

IUPACN-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine
SMILESCCOP(Cl)N(C(C)C)C(C)C
InChIInChI=1S/C8H19ClNOP/c1-6-11-12(9)10(7(2)3)8(4)5/h7-8H,6H2,1-5H3
InChIKeyZTSUQDFQNMCWAM-UHFFFAOYSA-N
MW211.67 g/mol
LogP3.61
Rot. Bonds5

About N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine

N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine (PubChem CID 14867282) has the molecular formula C8H19ClNOP and a molecular weight of 211.67 g/mol. Its IUPAC name is N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine
PubChem CID14867282
Molecular FormulaC8H19ClNOP
Molecular Weight211.67 g/mol
Exact Mass211.09
IUPAC NameN-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine
SMILESCCOP(Cl)N(C(C)C)C(C)C
InChIInChI=1S/C8H19ClNOP/c1-6-11-12(9)10(7(2)3)8(4)5/h7-8H,6H2,1-5H3
InChIKeyZTSUQDFQNMCWAM-UHFFFAOYSA-N
XLogP3.61
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.67
LogP ≤ 53.61
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-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine (CID 14867282) is N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine is CCOP(Cl)N(C(C)C)C(C)C.
What is the InChIKey of N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is ZTSUQDFQNMCWAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19ClNOP/c1-6-11-12(9)10(7(2)3)8(4)5/h7-8H,6H2,1-5H3.
What are the key properties of N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine?
N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 211.67 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[chloro(ethoxy)phosphanyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 14867282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).