N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide

C16H24N2OS — CID 174849650

IUPACN-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide
SMILESC=C(C)CN1CCCCC1C(=O)Nc1c(C)csc1C
InChIInChI=1S/C16H24N2OS/c1-11(2)9-18-8-6-5-7-14(18)16(19)17-15-12(3)10-20-13(15)4/h10,14H,1,5-9H2,2-4H3,(H,17,19)
InChIKeyZUSSNNGCKNASBZ-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.73
Rot. Bonds4

About N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide

N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide (PubChem CID 174849650) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide
PubChem CID174849650
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC NameN-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide
SMILESC=C(C)CN1CCCCC1C(=O)Nc1c(C)csc1C
InChIInChI=1S/C16H24N2OS/c1-11(2)9-18-8-6-5-7-14(18)16(19)17-15-12(3)10-20-13(15)4/h10,14H,1,5-9H2,2-4H3,(H,17,19)
InChIKeyZUSSNNGCKNASBZ-UHFFFAOYSA-N
XLogP3.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-(2,6-dimethylphenyl)-1-(2-oxopropyl)piperidine-2-carboxamide
CID 151727892
(2R,6S)-2-N,6-N-bis(2,4-dimethylthiophen-3-yl)-1-propylpiperidine-2,6-dicarboxamide
CID 141479943
(2S)-N-(2-ethynyl-4-methylthiophen-3-yl)-1-propylpiperidine-2-carboxamide
CID 141479959
N-[2-(difluoromethyl)-4-methylthiophen-3-yl]-1-propylpiperidine-2-carboxamide
CID 174849675
(2R)-N-(2,6-dimethylphenyl)-1-ethylpiperidine-2-carboxamide
CID 71421475
(2S)-N-(2,6-dimethylphenyl)-1-propylpiperidine-2-carboxamide;hydrate;hydrochloride
CID 6918111
1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide
CID 77242336
(2S)-N-(2,6-dimethylphenyl)-1-propylpiperidine-2-carboxamide;chloride;hydrate
CID 170923314
(2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide chloride
CID 154730536
1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;methanol
CID 66709536
N-(2,6-dimethylphenyl)-1-(4-fluorobutyl)piperidine-2-carboxamide;hydrochloride
CID 174853104
(2S)-N-(2,6-dimethylphenyl)-1-(4-fluorobutyl)piperidine-2-carboxamide;hydrochloride
CID 156775866

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide?
The IUPAC name of N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide (CID 174849650) is N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide?
The canonical SMILES for N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide is C=C(C)CN1CCCCC1C(=O)Nc1c(C)csc1C.
What is the InChIKey of N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide?
The InChIKey is ZUSSNNGCKNASBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-11(2)9-18-8-6-5-7-14(18)16(19)17-15-12(3)10-20-13(15)4/h10,14H,1,5-9H2,2-4H3,(H,17,19).
What are the key properties of N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide?
N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide has a molecular weight of 292.45 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylthiophen-3-yl)-1-(2-methylprop-2-enyl)piperidine-2-carboxamide is sourced from PubChem (CID 174849650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).