(3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide

C24H30N2O4S — CID 11619138

IUPAC(3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide
SMILESO=C(NC1CCCCC1)[C@H]1CCCN(S(=O)(=O)c2cccc(Oc3ccccc3)c2)C1
InChIInChI=1S/C24H30N2O4S/c27-24(25-20-10-3-1-4-11-20)19-9-8-16-26(18-19)31(28,29)23-15-7-14-22(17-23)30-21-12-5-2-6-13-21/h2,5-7,12-15,17,19-20H,1,3-4,8-11,16,18H2,(H,25,27)/t19-/m0/s1
InChIKeyIMFUYMFBXNVVDT-IBGZPJMESA-N
MW442.58 g/mol
LogP4.33
Rot. Bonds6

About (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide

(3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide (PubChem CID 11619138) has the molecular formula C24H30N2O4S and a molecular weight of 442.58 g/mol. Its IUPAC name is (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide
PubChem CID11619138
Molecular FormulaC24H30N2O4S
Molecular Weight442.58 g/mol
Exact Mass442.19
IUPAC Name(3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide
SMILESO=C(NC1CCCCC1)[C@H]1CCCN(S(=O)(=O)c2cccc(Oc3ccccc3)c2)C1
InChIInChI=1S/C24H30N2O4S/c27-24(25-20-10-3-1-4-11-20)19-9-8-16-26(18-19)31(28,29)23-15-7-14-22(17-23)30-21-12-5-2-6-13-21/h2,5-7,12-15,17,19-20H,1,3-4,8-11,16,18H2,(H,25,27)/t19-/m0/s1
InChIKeyIMFUYMFBXNVVDT-IBGZPJMESA-N
XLogP4.33
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.58
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-N-cyclohexyl-1-(3-methoxyphenyl)sulfonylpiperidine-3-carboxamide
CID 11531019
(3S)-1-(benzenesulfonyl)-N-cycloheptylpiperidine-3-carboxamide
CID 39898448
1-(3-chlorophenyl)sulfonyl-N-cycloheptylpiperidine-3-carboxamide
CID 69262233
N-(4-hydroxycyclohexyl)-1-[3-(2-methylphenoxy)phenyl]sulfonylpiperidine-3-carboxamide
CID 72992124
N-(3-hydroxycyclohexyl)-1-(3-methoxyphenyl)sulfonylpiperidine-3-carboxamide
CID 76823868
N-[1-(3-chlorophenyl)sulfonylpiperidin-3-yl]cyclohexanecarboxamide
CID 68875719
N-cyclohexyl-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide
CID 645701
(3S)-N-cyclohexyl-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide
CID 1081603
1-(3-bromophenyl)sulfonyl-N-cyclohexylpyrrolidine-3-carboxamide
CID 175666701
N-cyclopentyl-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide
CID 3153026
(3S)-N-cycloheptyl-1-(4-fluorophenyl)sulfonylpiperidine-3-carboxamide
CID 9268767
N-cycloheptyl-1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-3-carboxamide
CID 2979454

Frequently Asked Questions

What is the IUPAC name of (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide?
The IUPAC name of (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide (CID 11619138) is (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide.
What is the SMILES notation for (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide?
The canonical SMILES for (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide is O=C(NC1CCCCC1)[C@H]1CCCN(S(=O)(=O)c2cccc(Oc3ccccc3)c2)C1.
What is the InChIKey of (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide?
The InChIKey is IMFUYMFBXNVVDT-IBGZPJMESA-N. The full InChI is InChI=1S/C24H30N2O4S/c27-24(25-20-10-3-1-4-11-20)19-9-8-16-26(18-19)31(28,29)23-15-7-14-22(17-23)30-21-12-5-2-6-13-21/h2,5-7,12-15,17,19-20H,1,3-4,8-11,16,18H2,(H,25,27)/t19-/m0/s1.
What are the key properties of (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide?
(3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide has a molecular weight of 442.58 g/mol, XLogP of 4.33, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-cyclohexyl-1-(3-phenoxyphenyl)sulfonylpiperidine-3-carboxamide is sourced from PubChem (CID 11619138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).