3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol

C10H17NO — CID 106651375

IUPAC3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol
SMILESNC1CC(O)(C2=CCCCC2)C1
InChIInChI=1S/C10H17NO/c11-9-6-10(12,7-9)8-4-2-1-3-5-8/h4,9,12H,1-3,5-7,11H2
InChIKeyOCLCMANQYFEGMJ-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.34
Rot. Bonds1

About 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol

3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol (PubChem CID 106651375) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol.

Molecular Properties

Compound Name3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol
PubChem CID106651375
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol
SMILESNC1CC(O)(C2=CCCCC2)C1
InChIInChI=1S/C10H17NO/c11-9-6-10(12,7-9)8-4-2-1-3-5-8/h4,9,12H,1-3,5-7,11H2
InChIKeyOCLCMANQYFEGMJ-UHFFFAOYSA-N
XLogP1.34
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1S)-2-(aminomethyl)-1-heptylcycloprop-2-en-1-ol
CID 139365753
5-Amino-4-methyl-1-propan-2-ylcyclohex-2-en-1-ol
CID 144423340
1-(Cyclohexen-1-yl)-2-(1-methoxycyclobutyl)ethanamine
CID 103556338
3-Amino-1-(cycloocten-1-yl)cyclohexan-1-ol
CID 106651371
3-Amino-1-(cyclohexen-1-yl)cyclohexan-1-ol
CID 106651372
3-Amino-1-(cyclohepten-1-yl)cyclohexan-1-ol
CID 106651373
3-Amino-1-(cycloocten-1-yl)cyclobutan-1-ol
CID 106651374
3-Amino-1-(cyclohepten-1-yl)cyclobutan-1-ol
CID 106651376
4-Amino-1-(cycloocten-1-yl)cyclohexan-1-ol
CID 106651377
4-Amino-1-(cyclohexen-1-yl)cyclohexan-1-ol
CID 106651378
4-Amino-1-(cyclohepten-1-yl)cyclohexan-1-ol
CID 106651379
3-Amino-1-(cycloocten-1-yl)cyclopentan-1-ol
CID 106651380

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol?
The IUPAC name of 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol (CID 106651375) is 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol.
What is the SMILES notation for 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol?
The canonical SMILES for 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol is NC1CC(O)(C2=CCCCC2)C1.
What is the InChIKey of 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol?
The InChIKey is OCLCMANQYFEGMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c11-9-6-10(12,7-9)8-4-2-1-3-5-8/h4,9,12H,1-3,5-7,11H2.
What are the key properties of 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol?
3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol has a molecular weight of 167.25 g/mol, XLogP of 1.34, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(cyclohexen-1-yl)cyclobutan-1-ol is sourced from PubChem (CID 106651375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).