2-(2-ethylcyclohexyl)oxycycloheptan-1-amine

C15H29NO — CID 60725474

IUPAC2-(2-ethylcyclohexyl)oxycycloheptan-1-amine
SMILESCCC1CCCCC1OC1CCCCCC1N
InChIInChI=1S/C15H29NO/c1-2-12-8-6-7-10-14(12)17-15-11-5-3-4-9-13(15)16/h12-15H,2-11,16H2,1H3
InChIKeyRFYGYSNYZUGOSG-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.63
Rot. Bonds3

About 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine

2-(2-ethylcyclohexyl)oxycycloheptan-1-amine (PubChem CID 60725474) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine.

Molecular Properties

Compound Name2-(2-ethylcyclohexyl)oxycycloheptan-1-amine
PubChem CID60725474
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name2-(2-ethylcyclohexyl)oxycycloheptan-1-amine
SMILESCCC1CCCCC1OC1CCCCCC1N
InChIInChI=1S/C15H29NO/c1-2-12-8-6-7-10-14(12)17-15-11-5-3-4-9-13(15)16/h12-15H,2-11,16H2,1H3
InChIKeyRFYGYSNYZUGOSG-UHFFFAOYSA-N
XLogP3.63
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-bromo-2-(2-ethylcyclohexyl)oxycyclooctane
CID 114772757
1-bromo-2-(2-ethylcyclohexyl)oxycyclohexane
CID 63470245
2-(2-ethylcyclohexyl)cycloheptan-1-amine
CID 63861150
1-ethyl-2-hydroperoxycyclohexane
CID 175085860
cis-(1S,2R)-2-methoxycycloheptan-1-amine
CID 30817490
3-bromo-1-(2-ethylcyclohexyl)oxyspiro[3.5]nonane
CID 66344665
1-cyclohexyl-2-(2-ethylcyclohexyl)oxyethanamine
CID 104748736
1-[(2-ethylcyclohexyl)oxymethyl]cyclohexan-1-amine
CID 64574195
2-ethoxycyclopentan-1-amine
CID 16792821
2-(3,4-dimethylcyclohexyl)oxycyclooctan-1-amine
CID 64747111
2-(2-propoxyethoxy)cycloheptan-1-amine
CID 63685616
2-hexoxycyclododecan-1-amine
CID 43127854

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine?
The IUPAC name of 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine (CID 60725474) is 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine.
What is the SMILES notation for 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine?
The canonical SMILES for 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine is CCC1CCCCC1OC1CCCCCC1N.
What is the InChIKey of 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine?
The InChIKey is RFYGYSNYZUGOSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-2-12-8-6-7-10-14(12)17-15-11-5-3-4-9-13(15)16/h12-15H,2-11,16H2,1H3.
What are the key properties of 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine?
2-(2-ethylcyclohexyl)oxycycloheptan-1-amine has a molecular weight of 239.40 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylcyclohexyl)oxycycloheptan-1-amine is sourced from PubChem (CID 60725474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).