methyl-(4-pyrrolidin-1-ylphenyl)phosphane

C11H16NP — CID 143428794

IUPACmethyl-(4-pyrrolidin-1-ylphenyl)phosphane
SMILESCPc1ccc(N2CCCC2)cc1
InChIInChI=1S/C11H16NP/c1-13-11-6-4-10(5-7-11)12-8-2-3-9-12/h4-7,13H,2-3,8-9H2,1H3
InChIKeyHSTLOHWBSUOJFO-UHFFFAOYSA-N
MW193.23 g/mol
LogP2.22
Rot. Bonds2

About methyl-(4-pyrrolidin-1-ylphenyl)phosphane

methyl-(4-pyrrolidin-1-ylphenyl)phosphane (PubChem CID 143428794) has the molecular formula C11H16NP and a molecular weight of 193.23 g/mol. Its IUPAC name is methyl-(4-pyrrolidin-1-ylphenyl)phosphane.

Molecular Properties

Compound Namemethyl-(4-pyrrolidin-1-ylphenyl)phosphane
PubChem CID143428794
Molecular FormulaC11H16NP
Molecular Weight193.23 g/mol
Exact Mass193.10
IUPAC Namemethyl-(4-pyrrolidin-1-ylphenyl)phosphane
SMILESCPc1ccc(N2CCCC2)cc1
InChIInChI=1S/C11H16NP/c1-13-11-6-4-10(5-7-11)12-8-2-3-9-12/h4-7,13H,2-3,8-9H2,1H3
InChIKeyHSTLOHWBSUOJFO-UHFFFAOYSA-N
XLogP2.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,16-diazatricyclo[14.14.4.231,34]hexatriaconta-31,33,35-triene
CID 177496449
4-(4-pyrrolidin-1-ylphenyl)morpholine
CID 67305085
1-(4-methoxyphenyl)piperidine
CID 10130315
1-[4-(azepan-1-yl)phenyl]ethanamine
CID 43188750
1-[4-[1-(4-pyrrolidin-1-ylphenyl)prop-1-enyl]phenyl]pyrrolidine
CID 14343976
4-(azepan-1-yl)aniline;dihydrochloride
CID 16640674
4-(azepan-1-yl)aniline;hydrochloride
CID 6603137
1-[4-[2-(4-piperidin-1-ylphenyl)ethenyl]phenyl]piperidine
CID 56975979
1-methyl-4-(4-methylphenyl)-1,4-diazocane
CID 143370715
1-(4-pentan-3-ylphenyl)pyrrolidine
CID 168513845
methyl-[(4-pyrrolidin-1-ylphenyl)methyl]azanium
CID 7064072
(1S)-1-(4-piperidin-1-ylphenyl)ethanol
CID 10104408

Frequently Asked Questions

What is the IUPAC name of methyl-(4-pyrrolidin-1-ylphenyl)phosphane?
The IUPAC name of methyl-(4-pyrrolidin-1-ylphenyl)phosphane (CID 143428794) is methyl-(4-pyrrolidin-1-ylphenyl)phosphane.
What is the SMILES notation for methyl-(4-pyrrolidin-1-ylphenyl)phosphane?
The canonical SMILES for methyl-(4-pyrrolidin-1-ylphenyl)phosphane is CPc1ccc(N2CCCC2)cc1.
What is the InChIKey of methyl-(4-pyrrolidin-1-ylphenyl)phosphane?
The InChIKey is HSTLOHWBSUOJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16NP/c1-13-11-6-4-10(5-7-11)12-8-2-3-9-12/h4-7,13H,2-3,8-9H2,1H3.
What are the key properties of methyl-(4-pyrrolidin-1-ylphenyl)phosphane?
methyl-(4-pyrrolidin-1-ylphenyl)phosphane has a molecular weight of 193.23 g/mol, XLogP of 2.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-(4-pyrrolidin-1-ylphenyl)phosphane is sourced from PubChem (CID 143428794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).