2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide

C12H17N3O2S — CID 8894856

IUPAC2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)CN1CCCCC1
InChIInChI=1S/C12H17N3O2S/c13-11(17)9-4-7-18-12(9)14-10(16)8-15-5-2-1-3-6-15/h4,7H,1-3,5-6,8H2,(H2,13,17)(H,14,16)
InChIKeyKODPMFHWUFWKMR-UHFFFAOYSA-N
MW267.35 g/mol
LogP1.27
Rot. Bonds4

About 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide

2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide (PubChem CID 8894856) has the molecular formula C12H17N3O2S and a molecular weight of 267.35 g/mol. Its IUPAC name is 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide.

Molecular Properties

Compound Name2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide
PubChem CID8894856
Molecular FormulaC12H17N3O2S
Molecular Weight267.35 g/mol
Exact Mass267.10
IUPAC Name2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide
SMILESNC(=O)c1ccsc1NC(=O)CN1CCCCC1
InChIInChI=1S/C12H17N3O2S/c13-11(17)9-4-7-18-12(9)14-10(16)8-15-5-2-1-3-6-15/h4,7H,1-3,5-6,8H2,(H2,13,17)(H,14,16)
InChIKeyKODPMFHWUFWKMR-UHFFFAOYSA-N
XLogP1.27
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[[2-(azepan-1-yl)acetyl]amino]thiophene-3-carboxylate
CID 6471025
2-[[2-(3-aminoazetidin-1-yl)acetyl]amino]thiophene-3-carboxamide
CID 65249970
2-[[2-[4-(2-hydroxyphenyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide
CID 27156572
2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]thiophene-3-carboxamide
CID 8897472
2-[[2-[4-(thiophene-2-carbonyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide
CID 9362622
2-[[2-[4-(4-fluorobenzoyl)piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide
CID 36875697
2-[[2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]acetyl]amino]thiophene-3-carboxamide
CID 115647989
2-[[2-[(2S)-2-methylmorpholin-4-yl]acetyl]amino]thiophene-3-carboxamide
CID 30238407
2-[[2-[2-(hydroxymethyl)morpholin-4-yl]acetyl]amino]thiophene-3-carboxamide
CID 79833534
2-[(2-aminoacetyl)amino]thiophene-3-carboxamide
CID 60641622
[2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 2-(2-oxoazepan-1-yl)acetate
CID 7727491
2-[[2-[4-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]acetyl]amino]thiophene-3-carboxamide
CID 46568036

Frequently Asked Questions

What is the IUPAC name of 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
The IUPAC name of 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide (CID 8894856) is 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide.
What is the SMILES notation for 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
The canonical SMILES for 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide is NC(=O)c1ccsc1NC(=O)CN1CCCCC1.
What is the InChIKey of 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
The InChIKey is KODPMFHWUFWKMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2S/c13-11(17)9-4-7-18-12(9)14-10(16)8-15-5-2-1-3-6-15/h4,7H,1-3,5-6,8H2,(H2,13,17)(H,14,16).
What are the key properties of 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide?
2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide has a molecular weight of 267.35 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-piperidin-1-ylacetyl)amino]thiophene-3-carboxamide is sourced from PubChem (CID 8894856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).