N-ethyl-2,5-diphenylphospholan-1-amine

C18H22NP — CID 140850108

IUPACN-ethyl-2,5-diphenylphospholan-1-amine
SMILESCCNP1C(c2ccccc2)CCC1c1ccccc1
InChIInChI=1S/C18H22NP/c1-2-19-20-17(15-9-5-3-6-10-15)13-14-18(20)16-11-7-4-8-12-16/h3-12,17-19H,2,13-14H2,1H3
InChIKeyULURXQOLLZMVAO-UHFFFAOYSA-N
MW283.36 g/mol
LogP5.27
Rot. Bonds4

About N-ethyl-2,5-diphenylphospholan-1-amine

N-ethyl-2,5-diphenylphospholan-1-amine (PubChem CID 140850108) has the molecular formula C18H22NP and a molecular weight of 283.36 g/mol. Its IUPAC name is N-ethyl-2,5-diphenylphospholan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,5-diphenylphospholan-1-amine
PubChem CID140850108
Molecular FormulaC18H22NP
Molecular Weight283.36 g/mol
Exact Mass283.15
IUPAC NameN-ethyl-2,5-diphenylphospholan-1-amine
SMILESCCNP1C(c2ccccc2)CCC1c1ccccc1
InChIInChI=1S/C18H22NP/c1-2-19-20-17(15-9-5-3-6-10-15)13-14-18(20)16-11-7-4-8-12-16/h3-12,17-19H,2,13-14H2,1H3
InChIKeyULURXQOLLZMVAO-UHFFFAOYSA-N
XLogP5.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.36
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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-ethyl-2,5-diphenylphospholan-1-amine?
The IUPAC name of N-ethyl-2,5-diphenylphospholan-1-amine (CID 140850108) is N-ethyl-2,5-diphenylphospholan-1-amine.
What is the SMILES notation for N-ethyl-2,5-diphenylphospholan-1-amine?
The canonical SMILES for N-ethyl-2,5-diphenylphospholan-1-amine is CCNP1C(c2ccccc2)CCC1c1ccccc1.
What is the InChIKey of N-ethyl-2,5-diphenylphospholan-1-amine?
The InChIKey is ULURXQOLLZMVAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22NP/c1-2-19-20-17(15-9-5-3-6-10-15)13-14-18(20)16-11-7-4-8-12-16/h3-12,17-19H,2,13-14H2,1H3.
What are the key properties of N-ethyl-2,5-diphenylphospholan-1-amine?
N-ethyl-2,5-diphenylphospholan-1-amine has a molecular weight of 283.36 g/mol, XLogP of 5.27, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,5-diphenylphospholan-1-amine is sourced from PubChem (CID 140850108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).