N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide

C15H23N3O2S — CID 9264745

IUPACN-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide
SMILESCCCN1CCC(NC(=O)CNC(=O)c2cccs2)CC1
InChIInChI=1S/C15H23N3O2S/c1-2-7-18-8-5-12(6-9-18)17-14(19)11-16-15(20)13-4-3-10-21-13/h3-4,10,12H,2,5-9,11H2,1H3,(H,16,20)(H,17,19)
InChIKeyYASPYRUVFIZAFR-UHFFFAOYSA-N
MW309.43 g/mol
LogP1.47
Rot. Bonds6

About N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide

N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide (PubChem CID 9264745) has the molecular formula C15H23N3O2S and a molecular weight of 309.43 g/mol. Its IUPAC name is N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide
PubChem CID9264745
Molecular FormulaC15H23N3O2S
Molecular Weight309.43 g/mol
Exact Mass309.15
IUPAC NameN-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide
SMILESCCCN1CCC(NC(=O)CNC(=O)c2cccs2)CC1
InChIInChI=1S/C15H23N3O2S/c1-2-7-18-8-5-12(6-9-18)17-14(19)11-16-15(20)13-4-3-10-21-13/h3-4,10,12H,2,5-9,11H2,1H3,(H,16,20)(H,17,19)
InChIKeyYASPYRUVFIZAFR-UHFFFAOYSA-N
XLogP1.47
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.43
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(cyclooctylamino)-2-oxoethyl]thiophene-2-carboxamide
CID 4082368
cis-(1S,3R)-3-[[2-(thiophene-2-carbonylamino)acetyl]amino]cyclopentane-1-carboxylic acid
CID 120676600
N-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]propanamide
CID 118877843
3-(dimethylsulfamoyl)-N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]benzamide
CID 9293100
N-(1-ethylsulfonylpiperidin-4-yl)thiophene-2-carboxamide
CID 47150062
N-[2-oxo-2-[[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl]amino]ethyl]thiophene-2-carboxamide
CID 9163386
5-bromo-N-(1-propylpiperidin-4-yl)thiophene-2-carboxamide
CID 17249869
N-[2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 11896927
N-[2-[(2-ethylsulfanylcyclopentyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 71979779
N-[1-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]piperidin-4-yl]thiophene-2-carboxamide
CID 47548206
N-[4-(cyclopropylamino)-4-oxobutyl]thiophene-2-carboxamide
CID 51180198
2,6-dichloro-N-(1-propylpiperidin-4-yl)benzamide
CID 17249839

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide?
The IUPAC name of N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide (CID 9264745) is N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide?
The canonical SMILES for N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide is CCCN1CCC(NC(=O)CNC(=O)c2cccs2)CC1.
What is the InChIKey of N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide?
The InChIKey is YASPYRUVFIZAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2S/c1-2-7-18-8-5-12(6-9-18)17-14(19)11-16-15(20)13-4-3-10-21-13/h3-4,10,12H,2,5-9,11H2,1H3,(H,16,20)(H,17,19).
What are the key properties of N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide?
N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide has a molecular weight of 309.43 g/mol, XLogP of 1.47, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[(1-propylpiperidin-4-yl)amino]ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 9264745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).