2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine

C14H27NO — CID 114340866

IUPAC2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine
SMILESCC1(C)CCC(OC2CCCCC2N)CC1
InChIInChI=1S/C14H27NO/c1-14(2)9-7-11(8-10-14)16-13-6-4-3-5-12(13)15/h11-13H,3-10,15H2,1-2H3
InChIKeyPODFSSALSBTONZ-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.24
Rot. Bonds2

About 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine

2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine (PubChem CID 114340866) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine.

Molecular Properties

Compound Name2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine
PubChem CID114340866
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine
SMILESCC1(C)CCC(OC2CCCCC2N)CC1
InChIInChI=1S/C14H27NO/c1-14(2)9-7-11(8-10-14)16-13-6-4-3-5-12(13)15/h11-13H,3-10,15H2,1-2H3
InChIKeyPODFSSALSBTONZ-UHFFFAOYSA-N
XLogP3.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4,4-dimethylcyclohexyl)oxycyclopentan-1-amine
CID 114340845
1-(4,4-dimethylcyclohexyl)oxy-2-iodocycloheptane
CID 114775186
2-(3,4-dimethylcyclohexyl)oxycyclooctan-1-amine
CID 64747111
2-(4,4-dimethylcyclohexyl)oxy-N-ethylcycloheptan-1-amine
CID 114340804
cis-(1S,2R)-2-methoxycyclohexan-1-amine;hydrochloride
CID 67541561
cis-(1S,2R)-2-methoxycycloheptan-1-amine
CID 30817490
1,2-dicyclopropyloxycyclohexane
CID 175423114
2-(2-ethylcyclohexyl)oxycycloheptan-1-amine
CID 60725474
4-(3-chloro-2-methoxycyclobutyl)oxy-1,1-dimethylcyclohexane
CID 114342820
4-cyclopentyloxypiperidin-3-amine
CID 134577904
cis-(1S,2R)-2-propan-2-yloxycycloheptan-1-amine
CID 94519420
2-[(2-methylpropan-2-yl)oxy]cyclohexan-1-amine;hydrochloride
CID 172642150

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine?
The IUPAC name of 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine (CID 114340866) is 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine.
What is the SMILES notation for 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine?
The canonical SMILES for 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine is CC1(C)CCC(OC2CCCCC2N)CC1.
What is the InChIKey of 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine?
The InChIKey is PODFSSALSBTONZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-14(2)9-7-11(8-10-14)16-13-6-4-3-5-12(13)15/h11-13H,3-10,15H2,1-2H3.
What are the key properties of 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine?
2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethylcyclohexyl)oxycyclohexan-1-amine is sourced from PubChem (CID 114340866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).