N-(thiophen-2-ylmethylideneamino)undecanamide

C16H26N2OS — CID 2164157

IUPACN-(thiophen-2-ylmethylideneamino)undecanamide
SMILESCCCCCCCCCCC(=O)NN=Cc1cccs1
InChIInChI=1S/C16H26N2OS/c1-2-3-4-5-6-7-8-9-12-16(19)18-17-14-15-11-10-13-20-15/h10-11,13-14H,2-9,12H2,1H3,(H,18,19)
InChIKeySLIFHFKCWUWDMU-UHFFFAOYSA-N
MW294.46 g/mol
LogP4.73
Rot. Bonds11

About N-(thiophen-2-ylmethylideneamino)undecanamide

N-(thiophen-2-ylmethylideneamino)undecanamide (PubChem CID 2164157) has the molecular formula C16H26N2OS and a molecular weight of 294.46 g/mol. Its IUPAC name is N-(thiophen-2-ylmethylideneamino)undecanamide.

Molecular Properties

Compound NameN-(thiophen-2-ylmethylideneamino)undecanamide
PubChem CID2164157
Molecular FormulaC16H26N2OS
Molecular Weight294.46 g/mol
Exact Mass294.18
IUPAC NameN-(thiophen-2-ylmethylideneamino)undecanamide
SMILESCCCCCCCCCCC(=O)NN=Cc1cccs1
InChIInChI=1S/C16H26N2OS/c1-2-3-4-5-6-7-8-9-12-16(19)18-17-14-15-11-10-13-20-15/h10-11,13-14H,2-9,12H2,1H3,(H,18,19)
InChIKeySLIFHFKCWUWDMU-UHFFFAOYSA-N
XLogP4.73
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.46
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-thiophen-2-ylmethylideneamino]octanamide
CID 6894116
N-(thiophen-2-ylmethylideneamino)octadecanamide
CID 75087356
3-phenyl-N-[(Z)-thiophen-2-ylmethylideneamino]propanamide
CID 5414238
2-(dimethylamino)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide
CID 15703243
N-[(E)-benzylideneamino]heptanamide
CID 6083821
N-(benzylideneamino)decanamide
CID 3430585
N-(thiophen-3-ylmethylideneamino)decanamide
CID 4640197
N-[(Z)-(5-bromothiophen-2-yl)methylideneamino]hexanamide
CID 6167295
N-[(E)-pyridin-4-ylmethylideneamino]hexadecanamide
CID 45055038
N-[(2-hydroxyphenyl)methylideneamino]undecanamide
CID 5053269
N-[(2-hydroxyphenyl)methylideneamino]octanamide
CID 3393777
N-(1-thiophen-2-ylethylideneamino)octanamide
CID 2841814

Frequently Asked Questions

What is the IUPAC name of N-(thiophen-2-ylmethylideneamino)undecanamide?
The IUPAC name of N-(thiophen-2-ylmethylideneamino)undecanamide (CID 2164157) is N-(thiophen-2-ylmethylideneamino)undecanamide.
What is the SMILES notation for N-(thiophen-2-ylmethylideneamino)undecanamide?
The canonical SMILES for N-(thiophen-2-ylmethylideneamino)undecanamide is CCCCCCCCCCC(=O)NN=Cc1cccs1.
What is the InChIKey of N-(thiophen-2-ylmethylideneamino)undecanamide?
The InChIKey is SLIFHFKCWUWDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2OS/c1-2-3-4-5-6-7-8-9-12-16(19)18-17-14-15-11-10-13-20-15/h10-11,13-14H,2-9,12H2,1H3,(H,18,19).
What are the key properties of N-(thiophen-2-ylmethylideneamino)undecanamide?
N-(thiophen-2-ylmethylideneamino)undecanamide has a molecular weight of 294.46 g/mol, XLogP of 4.73, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiophen-2-ylmethylideneamino)undecanamide is sourced from PubChem (CID 2164157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).