5-(cyclohex-2-en-1-ylamino)pentan-2-ol

C11H21NO — CID 106131433

IUPAC5-(cyclohex-2-en-1-ylamino)pentan-2-ol
SMILESCC(O)CCCNC1C=CCCC1
InChIInChI=1S/C11H21NO/c1-10(13)6-5-9-12-11-7-3-2-4-8-11/h3,7,10-13H,2,4-6,8-9H2,1H3
InChIKeyYZBLUFRIHCNDCF-UHFFFAOYSA-N
MW183.30 g/mol
LogP1.85
Rot. Bonds5

About 5-(cyclohex-2-en-1-ylamino)pentan-2-ol

5-(cyclohex-2-en-1-ylamino)pentan-2-ol (PubChem CID 106131433) has the molecular formula C11H21NO and a molecular weight of 183.30 g/mol. Its IUPAC name is 5-(cyclohex-2-en-1-ylamino)pentan-2-ol.

Molecular Properties

Compound Name5-(cyclohex-2-en-1-ylamino)pentan-2-ol
PubChem CID106131433
Molecular FormulaC11H21NO
Molecular Weight183.30 g/mol
Exact Mass183.16
IUPAC Name5-(cyclohex-2-en-1-ylamino)pentan-2-ol
SMILESCC(O)CCCNC1C=CCCC1
InChIInChI=1S/C11H21NO/c1-10(13)6-5-9-12-11-7-3-2-4-8-11/h3,7,10-13H,2,4-6,8-9H2,1H3
InChIKeyYZBLUFRIHCNDCF-UHFFFAOYSA-N
XLogP1.85
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(5-methylhexyl)cyclohex-2-en-1-amine
CID 107907594
5-(cyclohex-2-en-1-ylamino)pentanamide
CID 106237404
N-(4-methylsulfanylbutyl)cyclohex-2-en-1-amine
CID 107234447
N-(3-methylsulfinylpropyl)cyclohex-2-en-1-amine
CID 107908089
N-cyclohex-2-en-1-yl-N',N'-dimethylethane-1,2-diamine
CID 103867344
5-[(4-methylcycloheptyl)amino]pentan-2-ol
CID 106121910
trans-(1S,2S)-2-(4-hydroxypentylamino)cyclohexan-1-ol
CID 106131373
3-(cyclohex-2-en-1-ylamino)propanoic acid
CID 114620369
3-[(cyclohex-2-en-1-ylamino)methyl]pentan-1-ol
CID 107907330
1-(cyclohex-2-en-1-ylamino)-3-ethylpentan-2-ol
CID 106285917
5-[(4-propan-2-ylcyclohexyl)amino]pentan-2-ol
CID 107267674
N-[3-(2-methylpiperidin-1-yl)propyl]cyclohex-2-en-1-amine
CID 107906360

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohex-2-en-1-ylamino)pentan-2-ol?
The IUPAC name of 5-(cyclohex-2-en-1-ylamino)pentan-2-ol (CID 106131433) is 5-(cyclohex-2-en-1-ylamino)pentan-2-ol.
What is the SMILES notation for 5-(cyclohex-2-en-1-ylamino)pentan-2-ol?
The canonical SMILES for 5-(cyclohex-2-en-1-ylamino)pentan-2-ol is CC(O)CCCNC1C=CCCC1.
What is the InChIKey of 5-(cyclohex-2-en-1-ylamino)pentan-2-ol?
The InChIKey is YZBLUFRIHCNDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-10(13)6-5-9-12-11-7-3-2-4-8-11/h3,7,10-13H,2,4-6,8-9H2,1H3.
What are the key properties of 5-(cyclohex-2-en-1-ylamino)pentan-2-ol?
5-(cyclohex-2-en-1-ylamino)pentan-2-ol has a molecular weight of 183.30 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohex-2-en-1-ylamino)pentan-2-ol is sourced from PubChem (CID 106131433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).