N-cyclooct-3-en-1-ylformamide

C9H15NO — CID 163931375

IUPACN-cyclooct-3-en-1-ylformamide
SMILESO=CNC1CC=CCCCC1
InChIInChI=1S/C9H15NO/c11-8-10-9-6-4-2-1-3-5-7-9/h2,4,8-9H,1,3,5-7H2,(H,10,11)
InChIKeyRIYAEEXLIVZOIY-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.62
Rot. Bonds2

About N-cyclooct-3-en-1-ylformamide

N-cyclooct-3-en-1-ylformamide (PubChem CID 163931375) has the molecular formula C9H15NO and a molecular weight of 153.23 g/mol. Its IUPAC name is N-cyclooct-3-en-1-ylformamide.

Molecular Properties

Compound NameN-cyclooct-3-en-1-ylformamide
PubChem CID163931375
Molecular FormulaC9H15NO
Molecular Weight153.23 g/mol
Exact Mass153.12
IUPAC NameN-cyclooct-3-en-1-ylformamide
SMILESO=CNC1CC=CCCCC1
InChIInChI=1S/C9H15NO/c11-8-10-9-6-4-2-1-3-5-7-9/h2,4,8-9H,1,3,5-7H2,(H,10,11)
InChIKeyRIYAEEXLIVZOIY-UHFFFAOYSA-N
XLogP1.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexylformamide;ethane
CID 143536975
N-cyclobutylformamide;methanol
CID 142523729
sodium;N-cyclohexylformamide;hydride
CID 173020638
1-cyclohex-3-en-1-yl-3-cyclopentylurea
CID 115640218
ethane;N-(3-methylcyclohexyl)formamide
CID 145231025
1-cyclooct-3-en-1-ylethanone
CID 66747175
1-[(1R,3Z)-cyclooct-3-en-1-yl]ethanone
CID 175990240
4-[[(3E)-cyclonon-3-en-1-yl]amino]benzoic acid
CID 70590167
4-[[(3E)-cyclodec-3-en-1-yl]amino]benzoic acid
CID 70593876
(3-formamidocyclohexyl)boronic acid
CID 87651069
(3E)-cyclooct-3-en-1-amine
CID 139404847
acetaldehyde;cyclohexene
CID 87322239

Frequently Asked Questions

What is the IUPAC name of N-cyclooct-3-en-1-ylformamide?
The IUPAC name of N-cyclooct-3-en-1-ylformamide (CID 163931375) is N-cyclooct-3-en-1-ylformamide.
What is the SMILES notation for N-cyclooct-3-en-1-ylformamide?
The canonical SMILES for N-cyclooct-3-en-1-ylformamide is O=CNC1CC=CCCCC1.
What is the InChIKey of N-cyclooct-3-en-1-ylformamide?
The InChIKey is RIYAEEXLIVZOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c11-8-10-9-6-4-2-1-3-5-7-9/h2,4,8-9H,1,3,5-7H2,(H,10,11).
What are the key properties of N-cyclooct-3-en-1-ylformamide?
N-cyclooct-3-en-1-ylformamide has a molecular weight of 153.23 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooct-3-en-1-ylformamide is sourced from PubChem (CID 163931375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).