1-cyclobutylcyclohex-3-en-1-amine

C10H17N — CID 130825828

IUPAC1-cyclobutylcyclohex-3-en-1-amine
SMILESNC1(C2CCC2)CC=CCC1
InChIInChI=1S/C10H17N/c11-10(9-5-4-6-9)7-2-1-3-8-10/h1-2,9H,3-8,11H2
InChIKeyREVBRYLFNAAUKQ-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.22
Rot. Bonds1

About 1-cyclobutylcyclohex-3-en-1-amine

1-cyclobutylcyclohex-3-en-1-amine (PubChem CID 130825828) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 1-cyclobutylcyclohex-3-en-1-amine.

Molecular Properties

Compound Name1-cyclobutylcyclohex-3-en-1-amine
PubChem CID130825828
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name1-cyclobutylcyclohex-3-en-1-amine
SMILESNC1(C2CCC2)CC=CCC1
InChIInChI=1S/C10H17N/c11-10(9-5-4-6-9)7-2-1-3-8-10/h1-2,9H,3-8,11H2
InChIKeyREVBRYLFNAAUKQ-UHFFFAOYSA-N
XLogP2.22
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-cyclooctylcyclooctan-1-amine
CID 19973273
spiro[4.6]undeca-2,8-diene
CID 123157263
bicyclo[3.2.0]heptan-1-amine
CID 148858770
spiro[4.7]dodec-9-ene
CID 173457967
(1S,6S)-bicyclo[4.1.0]heptan-1-amine
CID 55289374
(1S,6R)-bicyclo[4.1.0]heptan-1-amine
CID 124660494
1-cyclohexylcyclohexan-1-amine;nitrous acid
CID 157147588
1-cyclododecyl-2-cyclohexyl-3-cyclopentylcyclopentadecane-1,2,3-triamine
CID 151791002
1-cyclooctadec-8-en-1-yl-18-oxabicyclo[15.1.0]octadecane
CID 173352851
4-cyclopentylthian-4-amine
CID 83684340
1,2,3,4,7,8,9,9a-octahydrobenzo[7]annulen-4a-ol
CID 10511273
spiro[4.5]dec-8-en-4-ol
CID 130126404

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutylcyclohex-3-en-1-amine?
The IUPAC name of 1-cyclobutylcyclohex-3-en-1-amine (CID 130825828) is 1-cyclobutylcyclohex-3-en-1-amine.
What is the SMILES notation for 1-cyclobutylcyclohex-3-en-1-amine?
The canonical SMILES for 1-cyclobutylcyclohex-3-en-1-amine is NC1(C2CCC2)CC=CCC1.
What is the InChIKey of 1-cyclobutylcyclohex-3-en-1-amine?
The InChIKey is REVBRYLFNAAUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c11-10(9-5-4-6-9)7-2-1-3-8-10/h1-2,9H,3-8,11H2.
What are the key properties of 1-cyclobutylcyclohex-3-en-1-amine?
1-cyclobutylcyclohex-3-en-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutylcyclohex-3-en-1-amine is sourced from PubChem (CID 130825828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).