azacyclononadecan-2-ol

C18H37NO — CID 22924253

IUPACazacyclononadecan-2-ol
SMILESOC1CCCCCCCCCCCCCCCCCN1
InChIInChI=1S/C18H37NO/c20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-18/h18-20H,1-17H2
InChIKeyVQJSLLVZXCVLGT-UHFFFAOYSA-N
MW283.50 g/mol
LogP5.15
Rot. Bonds

About azacyclononadecan-2-ol

azacyclononadecan-2-ol (PubChem CID 22924253) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is azacyclononadecan-2-ol.

Molecular Properties

Compound Nameazacyclononadecan-2-ol
PubChem CID22924253
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Nameazacyclononadecan-2-ol
SMILESOC1CCCCCCCCCCCCCCCCCN1
InChIInChI=1S/C18H37NO/c20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-18/h18-20H,1-17H2
InChIKeyVQJSLLVZXCVLGT-UHFFFAOYSA-N
XLogP5.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.50
LogP ≤ 55.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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(2R)-2-methylazonane
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2-piperidin-2-ylcyclododecan-1-ol
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(3S)-3-aminoazepan-2-ol
CID 174814816
[(2S)-azepan-2-yl]methanol
CID 870731
azonane-2-thiol
CID 166727126
[(2S)-azepan-2-yl]methanol;hydrochloride
CID 163198382
azacyclohenicosane-2-carboxylic acid
CID 22341743
2-cyclodecylazecane
CID 126739440
(2S)-2-cyclohexylpiperidine
CID 7016471
2-methylpiperidine
CID 7974

Frequently Asked Questions

What is the IUPAC name of azacyclononadecan-2-ol?
The IUPAC name of azacyclononadecan-2-ol (CID 22924253) is azacyclononadecan-2-ol.
What is the SMILES notation for azacyclononadecan-2-ol?
The canonical SMILES for azacyclononadecan-2-ol is OC1CCCCCCCCCCCCCCCCCN1.
What is the InChIKey of azacyclononadecan-2-ol?
The InChIKey is VQJSLLVZXCVLGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-18/h18-20H,1-17H2.
What are the key properties of azacyclononadecan-2-ol?
azacyclononadecan-2-ol has a molecular weight of 283.50 g/mol, XLogP of 5.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azacyclononadecan-2-ol is sourced from PubChem (CID 22924253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).