N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide

C17H20N2O2S — CID 90522512

IUPACN-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1
InChIInChI=1S/C17H20N2O2S/c1-21-16-5-3-2-4-15(16)18-17(20)19-9-6-13(7-10-19)14-8-11-22-12-14/h2-5,8,11-13H,6-7,9-10H2,1H3,(H,18,20)
InChIKeyFVSYIMNZSBBIDC-UHFFFAOYSA-N
MW316.43 g/mol
LogP4.17
Rot. Bonds3

About N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide

N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide (PubChem CID 90522512) has the molecular formula C17H20N2O2S and a molecular weight of 316.43 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide
PubChem CID90522512
Molecular FormulaC17H20N2O2S
Molecular Weight316.43 g/mol
Exact Mass316.12
IUPAC NameN-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide
SMILESCOc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1
InChIInChI=1S/C17H20N2O2S/c1-21-16-5-3-2-4-15(16)18-17(20)19-9-6-13(7-10-19)14-8-11-22-12-14/h2-5,8,11-13H,6-7,9-10H2,1H3,(H,18,20)
InChIKeyFVSYIMNZSBBIDC-UHFFFAOYSA-N
XLogP4.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.43
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dimethoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide
CID 90522522
N-(2-methoxyphenyl)-4-(piperidine-1-carbonyl)piperidine-1-carboxamide
CID 27869689
N-(2-methoxyphenyl)-3-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidine-1-carboxamide
CID 121114744
4-cycloheptyl-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 113110513
N-(2-methoxyphenyl)-4-(piperidin-1-ylmethyl)piperidine-1-carboxamide
CID 126459311
N-(2-methoxyphenyl)-4-propan-2-ylpiperazine-1-carboxamide
CID 17185460
1-N-(2-methoxyphenyl)-4-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-1,4-dicarboxamide
CID 20973454
N-(2-ethoxyphenyl)-4-thiophen-2-ylpiperidine-1-carboxamide
CID 90522272
1-[(2-methoxyphenyl)carbamoyl]-4-methylpiperidine-4-carboxylic acid
CID 63123407
4-(2-hydroxyethyl)-N-(2-methoxyphenyl)piperazine-1-carboxamide
CID 43393054
(3S)-1-N-(2-methoxyphenyl)piperidine-1,3-dicarboxamide
CID 7372009
methyl 4-[(2-methoxyphenyl)carbamoyl]morpholine-2-carboxylate
CID 78927066

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide (CID 90522512) is N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide is COc1ccccc1NC(=O)N1CCC(c2ccsc2)CC1.
What is the InChIKey of N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide?
The InChIKey is FVSYIMNZSBBIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2S/c1-21-16-5-3-2-4-15(16)18-17(20)19-9-6-13(7-10-19)14-8-11-22-12-14/h2-5,8,11-13H,6-7,9-10H2,1H3,(H,18,20).
What are the key properties of N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide?
N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide has a molecular weight of 316.43 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 90522512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).