cyclohex-2-ene-1-carboximidamide

C7H12N2 — CID 56618074

IUPACcyclohex-2-ene-1-carboximidamide
SMILES[H]/N=C(\N)C1C=CCCC1
InChIInChI=1S/C7H12N2/c8-7(9)6-4-2-1-3-5-6/h2,4,6H,1,3,5H2,(H3,8,9)
InChIKeyGCZQCSWERLYOSA-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.28
Rot. Bonds1

About cyclohex-2-ene-1-carboximidamide

cyclohex-2-ene-1-carboximidamide (PubChem CID 56618074) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is cyclohex-2-ene-1-carboximidamide.

Molecular Properties

Compound Namecyclohex-2-ene-1-carboximidamide
PubChem CID56618074
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Namecyclohex-2-ene-1-carboximidamide
SMILES[H]/N=C(\N)C1C=CCCC1
InChIInChI=1S/C7H12N2/c8-7(9)6-4-2-1-3-5-6/h2,4,6H,1,3,5H2,(H3,8,9)
InChIKeyGCZQCSWERLYOSA-UHFFFAOYSA-N
XLogP1.28
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1S)-cyclohex-3-ene-1-carboximidamide
CID 34179902
Cyclohex-3-ene-1-carboximidamide hydrochloride
CID 42614706
Cyclohex-3-ene-1-carboximidamide
CID 42614707
(1S,4R)-4-(aminomethyl)cyclohex-2-ene-1-carboximidamide
CID 89721776
5-Iminocyclohex-3-ene-1-carboximidamide
CID 91208779
Cyclohexa-2,4-diene-1-carboximidamide
CID 132196625
5-Methylcyclohexa-2,4-diene-1-carboximidamide
CID 141889173
3-Methylcyclohex-3-ene-1-carboximidamide
CID 141982204
(Z)-3-methylhept-5-enimidamide
CID 146280233
(1R)-cyclohex-3-ene-1-carboximidamide
CID 34179897
2-Cyclohex-2-en-1-ylethanimidamide
CID 55285451
N'-hydroxycyclohex-3-ene-1-carboximidamide
CID 55289145

Frequently Asked Questions

What is the IUPAC name of cyclohex-2-ene-1-carboximidamide?
The IUPAC name of cyclohex-2-ene-1-carboximidamide (CID 56618074) is cyclohex-2-ene-1-carboximidamide.
What is the SMILES notation for cyclohex-2-ene-1-carboximidamide?
The canonical SMILES for cyclohex-2-ene-1-carboximidamide is [H]/N=C(\N)C1C=CCCC1.
What is the InChIKey of cyclohex-2-ene-1-carboximidamide?
The InChIKey is GCZQCSWERLYOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c8-7(9)6-4-2-1-3-5-6/h2,4,6H,1,3,5H2,(H3,8,9).
What are the key properties of cyclohex-2-ene-1-carboximidamide?
cyclohex-2-ene-1-carboximidamide has a molecular weight of 124.19 g/mol, XLogP of 1.28, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohex-2-ene-1-carboximidamide is sourced from PubChem (CID 56618074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).