methyl(1-pyrrolidin-1-ylethyl)phosphane

C7H16NP — CID 89331136

IUPACmethyl(1-pyrrolidin-1-ylethyl)phosphane
SMILESCPC(C)N1CCCC1
InChIInChI=1S/C7H16NP/c1-7(9-2)8-5-3-4-6-8/h7,9H,3-6H2,1-2H3
InChIKeyBJCMJWUYUFRUKI-UHFFFAOYSA-N
MW145.19 g/mol
LogP1.74
Rot. Bonds2

About methyl(1-pyrrolidin-1-ylethyl)phosphane

methyl(1-pyrrolidin-1-ylethyl)phosphane (PubChem CID 89331136) has the molecular formula C7H16NP and a molecular weight of 145.19 g/mol. Its IUPAC name is methyl(1-pyrrolidin-1-ylethyl)phosphane.

Molecular Properties

Compound Namemethyl(1-pyrrolidin-1-ylethyl)phosphane
PubChem CID89331136
Molecular FormulaC7H16NP
Molecular Weight145.19 g/mol
Exact Mass145.10
IUPAC Namemethyl(1-pyrrolidin-1-ylethyl)phosphane
SMILESCPC(C)N1CCCC1
InChIInChI=1S/C7H16NP/c1-7(9-2)8-5-3-4-6-8/h7,9H,3-6H2,1-2H3
InChIKeyBJCMJWUYUFRUKI-UHFFFAOYSA-N
XLogP1.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.19
LogP ≤ 51.74
H-Bond Donors ≤ 50
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 methyl(1-pyrrolidin-1-ylethyl)phosphane?
The IUPAC name of methyl(1-pyrrolidin-1-ylethyl)phosphane (CID 89331136) is methyl(1-pyrrolidin-1-ylethyl)phosphane.
What is the SMILES notation for methyl(1-pyrrolidin-1-ylethyl)phosphane?
The canonical SMILES for methyl(1-pyrrolidin-1-ylethyl)phosphane is CPC(C)N1CCCC1.
What is the InChIKey of methyl(1-pyrrolidin-1-ylethyl)phosphane?
The InChIKey is BJCMJWUYUFRUKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16NP/c1-7(9-2)8-5-3-4-6-8/h7,9H,3-6H2,1-2H3.
What are the key properties of methyl(1-pyrrolidin-1-ylethyl)phosphane?
methyl(1-pyrrolidin-1-ylethyl)phosphane has a molecular weight of 145.19 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(1-pyrrolidin-1-ylethyl)phosphane is sourced from PubChem (CID 89331136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).