N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide

C19H28N2O4S — CID 1263366

IUPACN-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide
SMILESCOc1ccc(C)cc1S(=O)(=O)N1CCC(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C19H28N2O4S/c1-14-7-8-17(25-2)18(13-14)26(23,24)21-11-9-15(10-12-21)19(22)20-16-5-3-4-6-16/h7-8,13,15-16H,3-6,9-12H2,1-2H3,(H,20,22)
InChIKeySBVGZUSKSCOOTP-UHFFFAOYSA-N
MW380.51 g/mol
LogP2.46
Rot. Bonds5

About N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide

N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide (PubChem CID 1263366) has the molecular formula C19H28N2O4S and a molecular weight of 380.51 g/mol. Its IUPAC name is N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide
PubChem CID1263366
Molecular FormulaC19H28N2O4S
Molecular Weight380.51 g/mol
Exact Mass380.18
IUPAC NameN-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide
SMILESCOc1ccc(C)cc1S(=O)(=O)N1CCC(C(=O)NC2CCCC2)CC1
InChIInChI=1S/C19H28N2O4S/c1-14-7-8-17(25-2)18(13-14)26(23,24)21-11-9-15(10-12-21)19(22)20-16-5-3-4-6-16/h7-8,13,15-16H,3-6,9-12H2,1-2H3,(H,20,22)
InChIKeySBVGZUSKSCOOTP-UHFFFAOYSA-N
XLogP2.46
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.51
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-{[1-(cyclopentylcarbonyl)-3-piperidinyl]methyl}-4-methoxybenzenesulfonamide
CID 16189375
1-(4-Methoxy-benzenesulfonyl)-piperidine-3-carboxylic acid cyclohexylamide
CID 645701
MicroRNA modulator-1
CID 5967303
1-(2-Methoxy-5-methyl-benzenesulfonyl)-4-methyl-piperidine
CID 646254
N-[2-(4-methoxyphenyl)ethyl]-1-methylsulfonylpiperidine-4-carboxamide
CID 894431
N-cyclopentyl-2-methoxy-5-methylbenzenesulfonamide
CID 967889
3-{4-[(isopropylamino)sulfonyl]phenyl}-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 1006951
N-cycloheptyl-1-[(4-methoxyphenyl)sulfonyl]-4-piperidinecarboxamide
CID 1075447
N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide
CID 1077703
1-(2,5-Dimethoxy-benzenesulfonyl)-piperidine-4-carboxylic acid cyclopentylamide
CID 1091445
N-cyclopropyl-1-[(4-methoxy-3-methylphenyl)sulfonyl]-4-piperidinecarboxamide
CID 1093382
1-[2-[(2-Methoxy-5-methylphenyl)sulfonyl-methylamino]acetyl]piperidine-4-carboxamide
CID 1095809

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide?
The IUPAC name of N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide (CID 1263366) is N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide is COc1ccc(C)cc1S(=O)(=O)N1CCC(C(=O)NC2CCCC2)CC1.
What is the InChIKey of N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide?
The InChIKey is SBVGZUSKSCOOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O4S/c1-14-7-8-17(25-2)18(13-14)26(23,24)21-11-9-15(10-12-21)19(22)20-16-5-3-4-6-16/h7-8,13,15-16H,3-6,9-12H2,1-2H3,(H,20,22).
What are the key properties of N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide?
N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide has a molecular weight of 380.51 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(2-methoxy-5-methylphenyl)sulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 1263366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).