3-cyclohex-2-en-1-yloxycyclopentan-1-amine

C11H19NO — CID 114620339

IUPAC3-cyclohex-2-en-1-yloxycyclopentan-1-amine
SMILESNC1CCC(OC2C=CCCC2)C1
InChIInChI=1S/C11H19NO/c12-9-6-7-11(8-9)13-10-4-2-1-3-5-10/h2,4,9-11H,1,3,5-8,12H2
InChIKeyFKBORZCRIWXOKH-UHFFFAOYSA-N
MW181.28 g/mol
LogP1.99
Rot. Bonds2

About 3-cyclohex-2-en-1-yloxycyclopentan-1-amine

3-cyclohex-2-en-1-yloxycyclopentan-1-amine (PubChem CID 114620339) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is 3-cyclohex-2-en-1-yloxycyclopentan-1-amine.

Molecular Properties

Compound Name3-cyclohex-2-en-1-yloxycyclopentan-1-amine
PubChem CID114620339
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Name3-cyclohex-2-en-1-yloxycyclopentan-1-amine
SMILESNC1CCC(OC2C=CCCC2)C1
InChIInChI=1S/C11H19NO/c12-9-6-7-11(8-9)13-10-4-2-1-3-5-10/h2,4,9-11H,1,3,5-8,12H2
InChIKeyFKBORZCRIWXOKH-UHFFFAOYSA-N
XLogP1.99
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1R)-5-fluoro-4-propan-2-yloxycyclohex-2-en-1-amine
CID 169580239
3-Cyclohex-2-en-1-yloxypropan-1-amine
CID 58684071
5-Cyclohexyloxycyclohex-3-en-1-amine
CID 89073915
4-Cyclopentyloxy-2-methylcyclohex-2-en-1-amine
CID 89154099
3-Cyclohex-2-en-1-yloxycyclobutan-1-amine
CID 114620337
3-Cyclohex-2-en-1-yloxypentan-1-amine
CID 142274343
3-But-2-enoxycyclopentan-1-amine
CID 79458892
3-But-3-en-2-yloxycyclopentan-1-amine
CID 79464741
4-(Oxolan-2-ylmethylidene)cyclohexan-1-amine
CID 79879471
(3Z)-3-(oxolan-2-ylmethylidene)cyclohexan-1-amine
CID 79880456
4-Cyclohex-2-en-1-yloxycyclohexan-1-amine
CID 102729307
2-Cyclohex-2-en-1-yloxycyclopentan-1-amine
CID 114620344

Frequently Asked Questions

What is the IUPAC name of 3-cyclohex-2-en-1-yloxycyclopentan-1-amine?
The IUPAC name of 3-cyclohex-2-en-1-yloxycyclopentan-1-amine (CID 114620339) is 3-cyclohex-2-en-1-yloxycyclopentan-1-amine.
What is the SMILES notation for 3-cyclohex-2-en-1-yloxycyclopentan-1-amine?
The canonical SMILES for 3-cyclohex-2-en-1-yloxycyclopentan-1-amine is NC1CCC(OC2C=CCCC2)C1.
What is the InChIKey of 3-cyclohex-2-en-1-yloxycyclopentan-1-amine?
The InChIKey is FKBORZCRIWXOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO/c12-9-6-7-11(8-9)13-10-4-2-1-3-5-10/h2,4,9-11H,1,3,5-8,12H2.
What are the key properties of 3-cyclohex-2-en-1-yloxycyclopentan-1-amine?
3-cyclohex-2-en-1-yloxycyclopentan-1-amine has a molecular weight of 181.28 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohex-2-en-1-yloxycyclopentan-1-amine is sourced from PubChem (CID 114620339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).