N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide

C38H40N2O2S — CID 19045660

IUPACN-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C38H40N2O2S/c41-43(42,37-22-21-32-15-10-11-16-34(32)29-37)39-30-38(35-17-6-2-7-18-35,36-19-8-3-9-20-36)25-12-26-40-27-23-33(24-28-40)31-13-4-1-5-14-31/h1-11,13-22,29,33,39H,12,23-28,30H2
InChIKeyPQLGFEZCSAKDLY-UHFFFAOYSA-N
MW588.82 g/mol
LogP7.76
Rot. Bonds11

About N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide

N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide (PubChem CID 19045660) has the molecular formula C38H40N2O2S and a molecular weight of 588.82 g/mol. Its IUPAC name is N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide
PubChem CID19045660
Molecular FormulaC38H40N2O2S
Molecular Weight588.82 g/mol
Exact Mass588.28
IUPAC NameN-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C38H40N2O2S/c41-43(42,37-22-21-32-15-10-11-16-34(32)29-37)39-30-38(35-17-6-2-7-18-35,36-19-8-3-9-20-36)25-12-26-40-27-23-33(24-28-40)31-13-4-1-5-14-31/h1-11,13-22,29,33,39H,12,23-28,30H2
InChIKeyPQLGFEZCSAKDLY-UHFFFAOYSA-N
XLogP7.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500588.82
LogP ≤ 57.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide 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

N-[3-(4-phenylpiperidin-1-yl)propyl]naphthalene-2-sulfonamide
CID 168832226
N-[3-[(2S)-2-phenylmorpholin-4-yl]propyl]naphthalene-2-sulfonamide
CID 30851092
N-(2-cyclopropyl-2-hydroxy-2-phenylethyl)naphthalene-2-sulfonamide
CID 90535526
[(2R)-1-[[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]amino]-1-oxopropan-2-yl]carbamic acid
CID 70098338
1-naphthalen-2-ylsulfonyl-4-phenylpiperidine
CID 4729267
N-[4-[(2S)-2-phenylmorpholin-4-yl]butyl]naphthalene-2-sulfonamide
CID 51866714
[1-hydroxy-4-(4-phenylpiperidin-1-yl)-1-phosphonobutyl]phosphonic acid
CID 11047477
N-[2-(4-chlorophenyl)-2-(4-methylphenyl)-5-(4-phenylpiperidin-1-yl)pentyl]-2-[(2-phenoxyacetyl)amino]acetamide
CID 142052199
N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide chloride
CID 45109707
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]naphthalene-2-sulfonamide
CID 42389457
tert-butyl N-[2-[[2,2-bis(4-chlorophenyl)-5-(4-phenylpiperidin-1-yl)pentyl]amino]-2-oxoethyl]carbamate
CID 70100459
N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513

Frequently Asked Questions

What is the IUPAC name of N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide (CID 19045660) is N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide is O=S(=O)(NCC(CCCN1CCC(c2ccccc2)CC1)(c1ccccc1)c1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide?
The InChIKey is PQLGFEZCSAKDLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H40N2O2S/c41-43(42,37-22-21-32-15-10-11-16-34(32)29-37)39-30-38(35-17-6-2-7-18-35,36-19-8-3-9-20-36)25-12-26-40-27-23-33(24-28-40)31-13-4-1-5-14-31/h1-11,13-22,29,33,39H,12,23-28,30H2.
What are the key properties of N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide?
N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide has a molecular weight of 588.82 g/mol, XLogP of 7.76, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-diphenyl-5-(4-phenylpiperidin-1-yl)pentyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 19045660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).