(4-piperidin-1-ylsulfonylphenyl)phosphane

C11H16NO2PS — CID 142954366

IUPAC(4-piperidin-1-ylsulfonylphenyl)phosphane
SMILESO=S(=O)(c1ccc(P)cc1)N1CCCCC1
InChIInChI=1S/C11H16NO2PS/c13-16(14,12-8-2-1-3-9-12)11-6-4-10(15)5-7-11/h4-7H,1-3,8-9,15H2
InChIKeyOOGIHNPPSAANJI-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.36
Rot. Bonds2

About (4-piperidin-1-ylsulfonylphenyl)phosphane

(4-piperidin-1-ylsulfonylphenyl)phosphane (PubChem CID 142954366) has the molecular formula C11H16NO2PS and a molecular weight of 257.29 g/mol. Its IUPAC name is (4-piperidin-1-ylsulfonylphenyl)phosphane.

Molecular Properties

Compound Name(4-piperidin-1-ylsulfonylphenyl)phosphane
PubChem CID142954366
Molecular FormulaC11H16NO2PS
Molecular Weight257.29 g/mol
Exact Mass257.06
IUPAC Name(4-piperidin-1-ylsulfonylphenyl)phosphane
SMILESO=S(=O)(c1ccc(P)cc1)N1CCCCC1
InChIInChI=1S/C11H16NO2PS/c13-16(14,12-8-2-1-3-9-12)11-6-4-10(15)5-7-11/h4-7H,1-3,8-9,15H2
InChIKeyOOGIHNPPSAANJI-UHFFFAOYSA-N
XLogP1.36
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 12715310
1-[4-(4-methylphenyl)phenyl]sulfonylazepane
CID 852205
4-(azocan-1-ylsulfonyl)benzoic acid
CID 23604687
4-[4-(azepan-1-ylsulfonyl)phenyl]sulfonylpiperazine-1-carbaldehyde
CID 1433317
N,N-dimethyl-4-piperidin-1-ylsulfonylbenzenesulfonamide
CID 859979
1-[4-[3-(4-piperidin-1-ylsulfonylphenyl)propyl]phenyl]sulfonylpiperidine
CID 124779418
4-(azepan-1-ylsulfonyl)-N-methylaniline
CID 43154646
(4-piperidin-1-ylsulfonylphenyl)hydrazine
CID 19351291
4-(azocan-1-ylsulfonyl)-N-methylaniline
CID 43332108
1-[4-[5-[4-(azepan-1-ylsulfonyl)phenyl]furan-2-yl]phenyl]sulfonylazepane
CID 50875581
1-(4-phenoxyphenyl)sulfonylpiperidine
CID 779936
[4-(azepan-1-ylsulfonyl)phenyl]-pyrrolidin-1-ylmethanone
CID 2444296

Frequently Asked Questions

What is the IUPAC name of (4-piperidin-1-ylsulfonylphenyl)phosphane?
The IUPAC name of (4-piperidin-1-ylsulfonylphenyl)phosphane (CID 142954366) is (4-piperidin-1-ylsulfonylphenyl)phosphane.
What is the SMILES notation for (4-piperidin-1-ylsulfonylphenyl)phosphane?
The canonical SMILES for (4-piperidin-1-ylsulfonylphenyl)phosphane is O=S(=O)(c1ccc(P)cc1)N1CCCCC1.
What is the InChIKey of (4-piperidin-1-ylsulfonylphenyl)phosphane?
The InChIKey is OOGIHNPPSAANJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16NO2PS/c13-16(14,12-8-2-1-3-9-12)11-6-4-10(15)5-7-11/h4-7H,1-3,8-9,15H2.
What are the key properties of (4-piperidin-1-ylsulfonylphenyl)phosphane?
(4-piperidin-1-ylsulfonylphenyl)phosphane has a molecular weight of 257.29 g/mol, XLogP of 1.36, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-piperidin-1-ylsulfonylphenyl)phosphane is sourced from PubChem (CID 142954366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).