1-(cyclooctylamino)propan-2-ol

C11H23NO — CID 20539535

IUPAC1-(cyclooctylamino)propan-2-ol
SMILESCC(O)CNC1CCCCCCC1
InChIInChI=1S/C11H23NO/c1-10(13)9-12-11-7-5-3-2-4-6-8-11/h10-13H,2-9H2,1H3
InChIKeyAOHZSPJWJSSJAF-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.07
Rot. Bonds3

About 1-(cyclooctylamino)propan-2-ol

1-(cyclooctylamino)propan-2-ol (PubChem CID 20539535) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(cyclooctylamino)propan-2-ol.

Molecular Properties

Compound Name1-(cyclooctylamino)propan-2-ol
PubChem CID20539535
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-(cyclooctylamino)propan-2-ol
SMILESCC(O)CNC1CCCCCCC1
InChIInChI=1S/C11H23NO/c1-10(13)9-12-11-7-5-3-2-4-6-8-11/h10-13H,2-9H2,1H3
InChIKeyAOHZSPJWJSSJAF-UHFFFAOYSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cycloheptylamino)propan-2-ol
CID 43392225
(2S)-1-(cyclopropylamino)propan-2-ol
CID 39234971
methanol;N-(2-methylpropyl)cyclopentanamine
CID 166557930
1-(azepan-4-ylamino)propan-2-ol
CID 103980928
ethane;N-(2-methylpropyl)cyclopentanamine
CID 156893756
(2R)-1-[(2-cyclohexylcyclohexyl)amino]propan-2-ol
CID 113349396
1-(thian-3-ylamino)propan-2-ol
CID 62873442
1-[(3-cyclopropylcyclohexyl)amino]propan-2-ol
CID 64593899
N-(2-cyclopropylpropyl)cyclooctanamine
CID 115592679
3-(cyclododecylamino)propane-1,2-diol
CID 66175077
(2R)-1-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-ol
CID 93033302
(2R)-1-[(1-iodopiperidin-4-yl)amino]propan-2-ol
CID 134342012

Frequently Asked Questions

What is the IUPAC name of 1-(cyclooctylamino)propan-2-ol?
The IUPAC name of 1-(cyclooctylamino)propan-2-ol (CID 20539535) is 1-(cyclooctylamino)propan-2-ol.
What is the SMILES notation for 1-(cyclooctylamino)propan-2-ol?
The canonical SMILES for 1-(cyclooctylamino)propan-2-ol is CC(O)CNC1CCCCCCC1.
What is the InChIKey of 1-(cyclooctylamino)propan-2-ol?
The InChIKey is AOHZSPJWJSSJAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-10(13)9-12-11-7-5-3-2-4-6-8-11/h10-13H,2-9H2,1H3.
What are the key properties of 1-(cyclooctylamino)propan-2-ol?
1-(cyclooctylamino)propan-2-ol has a molecular weight of 185.31 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclooctylamino)propan-2-ol is sourced from PubChem (CID 20539535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).