N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine

C12H24N2 — CID 131160327

IUPACN-(2-ethylcyclohexyl)-1-methylazetidin-3-amine
SMILESCCC1CCCCC1NC1CN(C)C1
InChIInChI=1S/C12H24N2/c1-3-10-6-4-5-7-12(10)13-11-8-14(2)9-11/h10-13H,3-9H2,1-2H3
InChIKeyKFXRIZPSPRWEAP-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.86
Rot. Bonds3

About N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine

N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine (PubChem CID 131160327) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine.

Molecular Properties

Compound NameN-(2-ethylcyclohexyl)-1-methylazetidin-3-amine
PubChem CID131160327
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC NameN-(2-ethylcyclohexyl)-1-methylazetidin-3-amine
SMILESCCC1CCCCC1NC1CN(C)C1
InChIInChI=1S/C12H24N2/c1-3-10-6-4-5-7-12(10)13-11-8-14(2)9-11/h10-13H,3-9H2,1-2H3
InChIKeyKFXRIZPSPRWEAP-UHFFFAOYSA-N
XLogP1.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylcyclohexyl)oxan-4-amine
CID 43709257
1-N-(2-ethylcyclohexyl)cyclobutane-1,3-diamine
CID 80559999
N-(2-ethylcyclohexyl)azepan-4-amine
CID 103981213
N-(2-ethylcyclohexyl)-1,2-dimethylpiperidin-4-amine
CID 81296650
2-ethyl-N-(2-ethylcyclopropyl)cyclohexan-1-amine
CID 103960948
2-ethyl-N-(3-methoxycyclobutyl)cyclohexan-1-amine
CID 104584298
N-(3,3-dimethylcyclobutyl)-2-ethylcyclopentan-1-amine
CID 130685162
N-(2-ethylcyclopentyl)-1,1-dioxothiolan-3-amine
CID 115707658
2-[4-[(2-ethylcyclohexyl)amino]piperidin-1-yl]cyclohexan-1-ol
CID 110017308
N-(2-ethylcyclopentyl)thian-3-amine
CID 115726681
2-ethyl-N-(4-phenylcyclohexyl)cyclohexan-1-amine
CID 43434154
N-(2-ethylcyclopentyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 115709909

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine?
The IUPAC name of N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine (CID 131160327) is N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine.
What is the SMILES notation for N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine?
The canonical SMILES for N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine is CCC1CCCCC1NC1CN(C)C1.
What is the InChIKey of N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine?
The InChIKey is KFXRIZPSPRWEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-3-10-6-4-5-7-12(10)13-11-8-14(2)9-11/h10-13H,3-9H2,1-2H3.
What are the key properties of N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine?
N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine has a molecular weight of 196.34 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclohexyl)-1-methylazetidin-3-amine is sourced from PubChem (CID 131160327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).