[2-(azepan-1-yl)cyclopentyl]methanol

C12H23NO — CID 106364698

IUPAC[2-(azepan-1-yl)cyclopentyl]methanol
SMILESOCC1CCCC1N1CCCCCC1
InChIInChI=1S/C12H23NO/c14-10-11-6-5-7-12(11)13-8-3-1-2-4-9-13/h11-12,14H,1-10H2
InChIKeyVDQPMWUTKBRFEP-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.02
Rot. Bonds2

About [2-(azepan-1-yl)cyclopentyl]methanol

[2-(azepan-1-yl)cyclopentyl]methanol (PubChem CID 106364698) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is [2-(azepan-1-yl)cyclopentyl]methanol.

Molecular Properties

Compound Name[2-(azepan-1-yl)cyclopentyl]methanol
PubChem CID106364698
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name[2-(azepan-1-yl)cyclopentyl]methanol
SMILESOCC1CCCC1N1CCCCCC1
InChIInChI=1S/C12H23NO/c14-10-11-6-5-7-12(11)13-8-3-1-2-4-9-13/h11-12,14H,1-10H2
InChIKeyVDQPMWUTKBRFEP-UHFFFAOYSA-N
XLogP2.02
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-(azepan-1-yl)cyclopentyl]methanol with MolForge

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Related Compounds

[(8S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-8-yl]methanol
CID 11019091
[(2S)-2-(azetidin-1-yl)cyclohexyl]methanol
CID 58117124
[2-(azepan-1-yl)cyclopentyl]methanamine
CID 43293383
(2-piperidin-1-ylcyclopropyl)methanol
CID 130678340
[2-(3-ethylazetidin-1-yl)cyclopentyl]methanol
CID 106364703
[2-(2-azaspiro[3.5]nonan-2-yl)cyclohexyl]methanol
CID 114179212
[2-(1,2,3,5,6,7,8,8a-octahydroindolizin-1-ylamino)cyclohexyl]methanol
CID 114178522
[1-[[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl]piperidin-2-yl]methanol;dihydrochloride
CID 52994083
trans-(1S,2S)-2-piperidin-1-ylcyclopentan-1-ol
CID 54511107
1-ethyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
CID 20980731
[(1R,9aS)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methyl hydrogen sulfate
CID 7061084
2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]acetic acid
CID 131186064

Frequently Asked Questions

What is the IUPAC name of [2-(azepan-1-yl)cyclopentyl]methanol?
The IUPAC name of [2-(azepan-1-yl)cyclopentyl]methanol (CID 106364698) is [2-(azepan-1-yl)cyclopentyl]methanol.
What is the SMILES notation for [2-(azepan-1-yl)cyclopentyl]methanol?
The canonical SMILES for [2-(azepan-1-yl)cyclopentyl]methanol is OCC1CCCC1N1CCCCCC1.
What is the InChIKey of [2-(azepan-1-yl)cyclopentyl]methanol?
The InChIKey is VDQPMWUTKBRFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c14-10-11-6-5-7-12(11)13-8-3-1-2-4-9-13/h11-12,14H,1-10H2.
What are the key properties of [2-(azepan-1-yl)cyclopentyl]methanol?
[2-(azepan-1-yl)cyclopentyl]methanol has a molecular weight of 197.32 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(azepan-1-yl)cyclopentyl]methanol is sourced from PubChem (CID 106364698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).