2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine

C11H22N2 — CID 79677400

IUPAC2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine
SMILESCC1(C)CN(C2CCCCC2N)C1
InChIInChI=1S/C11H22N2/c1-11(2)7-13(8-11)10-6-4-3-5-9(10)12/h9-10H,3-8,12H2,1-2H3
InChIKeyPROJUQGRNHNPSP-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.60
Rot. Bonds1

About 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine

2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine (PubChem CID 79677400) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine
PubChem CID79677400
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine
SMILESCC1(C)CN(C2CCCCC2N)C1
InChIInChI=1S/C11H22N2/c1-11(2)7-13(8-11)10-6-4-3-5-9(10)12/h9-10H,3-8,12H2,1-2H3
InChIKeyPROJUQGRNHNPSP-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-(3,3-dipropylazetidin-1-yl)cyclohexan-1-amine
CID 102738924
cis-(1R,2S)-2-pyrrolidin-1-ylcyclohexan-1-amine;dihydrochloride
CID 66680564
2-(3,3-dimethylazetidin-1-yl)cyclohexane-1-carboxylic acid
CID 79695533
2-(4-methylpiperazin-1-yl)cyclododecan-1-amine
CID 16790088
2-(3,4-dimethylpyrrolidin-1-yl)cyclopentan-1-amine
CID 79188038
2-(4-cyclopentylpiperazin-1-yl)cyclohexan-1-amine
CID 62368613
2-(3-propan-2-ylazetidin-1-yl)cycloheptan-1-amine
CID 79678858
2-(8-azaspiro[4.5]decan-8-yl)cycloheptan-1-amine
CID 63160830
2-(3,4,5-trimethylpiperazin-1-yl)cycloheptan-1-amine
CID 114537803
trans-(1R,2R)-2-(4-methylpiperidin-1-yl)cyclopentan-1-amine
CID 30819011
1-(2-aminocyclopentyl)-4-methylazepan-4-ol
CID 107407606
2-(4-methoxypiperidin-1-yl)cyclododecan-1-amine
CID 43372793

Frequently Asked Questions

What is the IUPAC name of 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine?
The IUPAC name of 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine (CID 79677400) is 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine.
What is the SMILES notation for 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine?
The canonical SMILES for 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine is CC1(C)CN(C2CCCCC2N)C1.
What is the InChIKey of 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine?
The InChIKey is PROJUQGRNHNPSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-11(2)7-13(8-11)10-6-4-3-5-9(10)12/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine?
2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,3-dimethylazetidin-1-yl)cyclohexan-1-amine is sourced from PubChem (CID 79677400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).