2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol

C14H27NO2 — CID 106940021

IUPAC2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol
SMILESNC1(COC2CCCCCC2O)CCCCC1
InChIInChI=1S/C14H27NO2/c15-14(9-5-2-6-10-14)11-17-13-8-4-1-3-7-12(13)16/h12-13,16H,1-11,15H2
InChIKeyGSMZLAUHMBPTCG-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.36
Rot. Bonds3

About 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol

2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol (PubChem CID 106940021) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol.

Molecular Properties

Compound Name2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol
PubChem CID106940021
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol
SMILESNC1(COC2CCCCCC2O)CCCCC1
InChIInChI=1S/C14H27NO2/c15-14(9-5-2-6-10-14)11-17-13-8-4-1-3-7-12(13)16/h12-13,16H,1-11,15H2
InChIKeyGSMZLAUHMBPTCG-UHFFFAOYSA-N
XLogP2.36
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(2-ethylcyclohexyl)oxymethyl]cyclohexan-1-amine
CID 64574195
1-(cyclohexyloxymethyl)cycloheptan-1-amine
CID 64548745
2-ethoxycyclooctan-1-ol
CID 18953000
2-(hydroxymethoxy)cyclohexan-1-ol
CID 67785185
2-(cyclopentylmethoxy)cycloheptan-1-ol
CID 66324580
2-(cyclohexylmethoxy)cyclohexan-1-ol
CID 62383231
1-(cyclohex-2-en-1-yloxymethyl)cyclohexan-1-amine
CID 114620327
cis-(1R,2S)-2-[2-[2-[(1R,2S)-2-hydroxycyclohexyl]oxyethoxy]ethoxy]cyclohexan-1-ol
CID 10891991
1-[(3-ethylcyclohexyl)oxymethyl]cyclohexan-1-amine
CID 64571862
1-[(3-methylcyclohexyl)oxymethyl]cycloheptan-1-amine
CID 64548755
2-(1-aminocyclopentyl)-N-(2-hydroxycyclohexyl)acetamide
CID 64677437
2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]cyclododecan-1-ol
CID 115942497

Frequently Asked Questions

What is the IUPAC name of 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol?
The IUPAC name of 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol (CID 106940021) is 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol.
What is the SMILES notation for 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol?
The canonical SMILES for 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol is NC1(COC2CCCCCC2O)CCCCC1.
What is the InChIKey of 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol?
The InChIKey is GSMZLAUHMBPTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c15-14(9-5-2-6-10-14)11-17-13-8-4-1-3-7-12(13)16/h12-13,16H,1-11,15H2.
What are the key properties of 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol?
2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol has a molecular weight of 241.37 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-aminocyclohexyl)methoxy]cycloheptan-1-ol is sourced from PubChem (CID 106940021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).