N-(thiophen-2-ylmethylideneamino)formamide

C6H6N2OS — CID 4188551

IUPACN-(thiophen-2-ylmethylideneamino)formamide
SMILESO=CNN=Cc1cccs1
InChIInChI=1S/C6H6N2OS/c9-5-8-7-4-6-2-1-3-10-6/h1-5H,(H,8,9)
InChIKeyWPXDNGIPLLGTAX-UHFFFAOYSA-N
MW154.19 g/mol
LogP0.83
Rot. Bonds3

About N-(thiophen-2-ylmethylideneamino)formamide

N-(thiophen-2-ylmethylideneamino)formamide (PubChem CID 4188551) has the molecular formula C6H6N2OS and a molecular weight of 154.19 g/mol. Its IUPAC name is N-(thiophen-2-ylmethylideneamino)formamide.

Molecular Properties

Compound NameN-(thiophen-2-ylmethylideneamino)formamide
PubChem CID4188551
Molecular FormulaC6H6N2OS
Molecular Weight154.19 g/mol
Exact Mass154.02
IUPAC NameN-(thiophen-2-ylmethylideneamino)formamide
SMILESO=CNN=Cc1cccs1
InChIInChI=1S/C6H6N2OS/c9-5-8-7-4-6-2-1-3-10-6/h1-5H,(H,8,9)
InChIKeyWPXDNGIPLLGTAX-UHFFFAOYSA-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

N-[(E)-thiophen-2-ylmethylideneamino]carbamate
CID 23220005
2,2,2-trichloro-N-[(E)-thiophen-2-ylmethylideneamino]acetamide
CID 11000179
(NZ)-N-(thiophen-2-ylmethylidene)hydroxylamine
CID 5371572
thiophene-2-carbaldehyde;hydrobromide
CID 20535828
N-(thiophen-2-ylmethylidene)thiophene-2-sulfonamide
CID 693839
4-methyl-N-[(Z)-thiophen-2-ylmethylideneamino]benzamide
CID 5413555
tert-butyl N-[(Z)-thiophen-2-ylmethylideneamino]carbamate
CID 5399730
2-(dimethylamino)-N-[(E)-thiophen-2-ylmethylideneamino]acetamide
CID 15703243
4-chloro-N-(thiophen-2-ylmethylideneamino)benzenesulfonamide
CID 874023
2,3,5,6-tetrafluoro-N-[(Z)-thiophen-2-ylmethylideneamino]aniline
CID 6260448
N-[(E)-thiophen-3-ylmethylideneamino]formamide
CID 6903063
2-fluoro-N-(thiophen-2-ylmethylideneamino)benzamide
CID 5108019

Frequently Asked Questions

What is the IUPAC name of N-(thiophen-2-ylmethylideneamino)formamide?
The IUPAC name of N-(thiophen-2-ylmethylideneamino)formamide (CID 4188551) is N-(thiophen-2-ylmethylideneamino)formamide.
What is the SMILES notation for N-(thiophen-2-ylmethylideneamino)formamide?
The canonical SMILES for N-(thiophen-2-ylmethylideneamino)formamide is O=CNN=Cc1cccs1.
What is the InChIKey of N-(thiophen-2-ylmethylideneamino)formamide?
The InChIKey is WPXDNGIPLLGTAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2OS/c9-5-8-7-4-6-2-1-3-10-6/h1-5H,(H,8,9).
What are the key properties of N-(thiophen-2-ylmethylideneamino)formamide?
N-(thiophen-2-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-(thiophen-2-ylmethylideneamino)formamide is sourced from PubChem (CID 4188551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).