N-[(E)-thiophen-3-ylmethylideneamino]formamide

C6H6N2OS — CID 6903063

IUPACN-[(E)-thiophen-3-ylmethylideneamino]formamide
SMILESO=CN/N=C/c1ccsc1
InChIInChI=1S/C6H6N2OS/c9-5-8-7-3-6-1-2-10-4-6/h1-5H,(H,8,9)/b7-3+
InChIKeyDYLQZMHYFUILFF-XVNBXDOJSA-N
MW154.19 g/mol
LogP0.83
Rot. Bonds3

About N-[(E)-thiophen-3-ylmethylideneamino]formamide

N-[(E)-thiophen-3-ylmethylideneamino]formamide (PubChem CID 6903063) has the molecular formula C6H6N2OS and a molecular weight of 154.19 g/mol. Its IUPAC name is N-[(E)-thiophen-3-ylmethylideneamino]formamide.

Molecular Properties

Compound NameN-[(E)-thiophen-3-ylmethylideneamino]formamide
PubChem CID6903063
Molecular FormulaC6H6N2OS
Molecular Weight154.19 g/mol
Exact Mass154.02
IUPAC NameN-[(E)-thiophen-3-ylmethylideneamino]formamide
SMILESO=CN/N=C/c1ccsc1
InChIInChI=1S/C6H6N2OS/c9-5-8-7-3-6-1-2-10-4-6/h1-5H,(H,8,9)/b7-3+
InChIKeyDYLQZMHYFUILFF-XVNBXDOJSA-N
XLogP0.83
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', '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

dichloronickel;bis([(E)-thiophen-3-ylmethylideneamino]urea)
CID 86573341
4-[(2Z)-2-(thiophen-3-ylmethylidene)hydrazinyl]benzoic acid
CID 9013174
4-chloro-N-(thiophen-3-ylmethylideneamino)benzenesulfonamide
CID 4167006
N-(thiophen-2-ylmethylideneamino)formamide
CID 4188551
N-(thiophen-3-ylmethylideneamino)decanamide
CID 4640197
N-[(E)-(4-ethylphenyl)methylideneamino]formamide
CID 6903320
2-pyridin-1-ium-1-yl-N-[(E)-thiophen-3-ylmethylideneamino]acetamide
CID 15703176
4-propan-2-yl-N-(thiophen-3-ylmethylideneamino)benzamide
CID 5155397
2,2-diphenoxy-N-[(Z)-thiophen-3-ylmethylideneamino]acetamide
CID 5499251
(E)-1-thiophen-3-yl-N-[thiophen-3-yl-[(E)-thiophen-3-ylmethylideneamino]methyl]methanimine
CID 177399680
2-(4-methylphenoxy)-N-(thiophen-3-ylmethylideneamino)acetamide
CID 4980484
4-(propanoylamino)-N-(thiophen-3-ylmethylideneamino)benzamide
CID 4980480

Frequently Asked Questions

What is the IUPAC name of N-[(E)-thiophen-3-ylmethylideneamino]formamide?
The IUPAC name of N-[(E)-thiophen-3-ylmethylideneamino]formamide (CID 6903063) is N-[(E)-thiophen-3-ylmethylideneamino]formamide.
What is the SMILES notation for N-[(E)-thiophen-3-ylmethylideneamino]formamide?
The canonical SMILES for N-[(E)-thiophen-3-ylmethylideneamino]formamide is O=CN/N=C/c1ccsc1.
What is the InChIKey of N-[(E)-thiophen-3-ylmethylideneamino]formamide?
The InChIKey is DYLQZMHYFUILFF-XVNBXDOJSA-N. The full InChI is InChI=1S/C6H6N2OS/c9-5-8-7-3-6-1-2-10-4-6/h1-5H,(H,8,9)/b7-3+.
What are the key properties of N-[(E)-thiophen-3-ylmethylideneamino]formamide?
N-[(E)-thiophen-3-ylmethylideneamino]formamide has a molecular weight of 154.19 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-thiophen-3-ylmethylideneamino]formamide is sourced from PubChem (CID 6903063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).