N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide

C18H24N2O2S — CID 43057486

IUPACN-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SMILESO=C(NC(C1CC1)C1CC1)C1CCCN(C(=O)c2cccs2)C1
InChIInChI=1S/C18H24N2O2S/c21-17(19-16(12-5-6-12)13-7-8-13)14-3-1-9-20(11-14)18(22)15-4-2-10-23-15/h2,4,10,12-14,16H,1,3,5-9,11H2,(H,19,21)
InChIKeyLXFSHYDGUYPSAT-UHFFFAOYSA-N
MW332.47 g/mol
LogP2.91
Rot. Bonds5

About N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide

N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide (PubChem CID 43057486) has the molecular formula C18H24N2O2S and a molecular weight of 332.47 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
PubChem CID43057486
Molecular FormulaC18H24N2O2S
Molecular Weight332.47 g/mol
Exact Mass332.16
IUPAC NameN-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SMILESO=C(NC(C1CC1)C1CC1)C1CCCN(C(=O)c2cccs2)C1
InChIInChI=1S/C18H24N2O2S/c21-17(19-16(12-5-6-12)13-7-8-13)14-3-1-9-20(11-14)18(22)15-4-2-10-23-15/h2,4,10,12-14,16H,1,3,5-9,11H2,(H,19,21)
InChIKeyLXFSHYDGUYPSAT-UHFFFAOYSA-N
XLogP2.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-N-[(2R)-4-methylpentan-2-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 97013445
N-(1-hydroxybutan-2-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 110886255
N-(2,2-dimethyl-1-phenylpropyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55643259
(3R)-1-(thiophene-2-carbonyl)piperidine-3-carboxylic acid
CID 858666
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42947169
N-[1-(4-bromophenyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42885431
(3S)-N-[(1S)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 129376970
(3S)-N-propyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 39977852
N-[1-(4-cyanophenyl)ethyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 134035121
(3S)-N-[(1R,2R)-2-methylcyclohexyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 124743110
(3S)-N-[(1S,2R)-2-methylcyclohexyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 124743109
N-(4-bromophenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946615

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The IUPAC name of N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide (CID 43057486) is N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide is O=C(NC(C1CC1)C1CC1)C1CCCN(C(=O)c2cccs2)C1.
What is the InChIKey of N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The InChIKey is LXFSHYDGUYPSAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2S/c21-17(19-16(12-5-6-12)13-7-8-13)14-3-1-9-20(11-14)18(22)15-4-2-10-23-15/h2,4,10,12-14,16H,1,3,5-9,11H2,(H,19,21).
What are the key properties of N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide has a molecular weight of 332.47 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 43057486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).