N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide

C19H23N3O2S — CID 91903510

IUPACN-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)Nc2ccccc2)CC1)c1ccsc1
InChIInChI=1S/C19H23N3O2S/c23-18(16-9-13-25-14-16)20-10-6-15-7-11-22(12-8-15)19(24)21-17-4-2-1-3-5-17/h1-5,9,13-15H,6-8,10-12H2,(H,20,23)(H,21,24)
InChIKeyHQWPHMKHVMQVQO-UHFFFAOYSA-N
MW357.48 g/mol
LogP3.81
Rot. Bonds5

About N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide

N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide (PubChem CID 91903510) has the molecular formula C19H23N3O2S and a molecular weight of 357.48 g/mol. Its IUPAC name is N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide
PubChem CID91903510
Molecular FormulaC19H23N3O2S
Molecular Weight357.48 g/mol
Exact Mass357.15
IUPAC NameN-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCC1CCN(C(=O)Nc2ccccc2)CC1)c1ccsc1
InChIInChI=1S/C19H23N3O2S/c23-18(16-9-13-25-14-16)20-10-6-15-7-11-22(12-8-15)19(24)21-17-4-2-1-3-5-17/h1-5,9,13-15H,6-8,10-12H2,(H,20,23)(H,21,24)
InChIKeyHQWPHMKHVMQVQO-UHFFFAOYSA-N
XLogP3.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(3-methoxypropanoylamino)ethyl]-N-phenylpiperidine-1-carboxamide
CID 91913194
4-[2-[(3-fluorobenzoyl)amino]ethyl]-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 91903544
4-[2-[[2-(3-methoxyphenyl)acetyl]amino]ethyl]-N-phenylpiperidine-1-carboxamide
CID 46381852
N-[2-[1-[(4-fluorophenyl)carbamoyl]piperidin-4-yl]ethyl]pyridine-2-carboxamide
CID 91913215
N-[3-[3-(hydroxymethyl)pyrrolidin-1-yl]-3-oxopropyl]thiophene-3-carboxamide
CID 62370593
4-[2-[(2-methoxybenzoyl)amino]ethyl]-N-(4-methylphenyl)piperidine-1-carboxamide
CID 91913285
4-benzyl-N-phenylpiperidine-1-carboxamide
CID 5064762
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
4-[2-[(3-methylbenzoyl)amino]ethyl]-N-(2-methylphenyl)piperidine-1-carboxamide
CID 91903569
N-(4-methylphenyl)-4-[2-(2-methylpropanoylamino)ethyl]piperidine-1-carboxamide
CID 91903591
4-(phenoxymethyl)-N-phenylpiperidine-1-carboxamide
CID 110638783
N-[3-oxo-3-(4-phenylanilino)propyl]thiophene-3-carboxamide
CID 46580901

Frequently Asked Questions

What is the IUPAC name of N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide?
The IUPAC name of N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide (CID 91903510) is N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide is O=C(NCCC1CCN(C(=O)Nc2ccccc2)CC1)c1ccsc1.
What is the InChIKey of N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide?
The InChIKey is HQWPHMKHVMQVQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2S/c23-18(16-9-13-25-14-16)20-10-6-15-7-11-22(12-8-15)19(24)21-17-4-2-1-3-5-17/h1-5,9,13-15H,6-8,10-12H2,(H,20,23)(H,21,24).
What are the key properties of N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide?
N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide has a molecular weight of 357.48 g/mol, XLogP of 3.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4-[2-(thiophene-3-carbonylamino)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 91903510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).