N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine

C13H26N2 — CID 166536648

IUPACN-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine
SMILESCCN(C1CCC(C)CC1)C1CN(C)C1
InChIInChI=1S/C13H26N2/c1-4-15(13-9-14(3)10-13)12-7-5-11(2)6-8-12/h11-13H,4-10H2,1-3H3
InChIKeySNWCOARMRWZMOX-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.20
Rot. Bonds3

About N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine

N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine (PubChem CID 166536648) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine.

Molecular Properties

Compound NameN-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine
PubChem CID166536648
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine
SMILESCCN(C1CCC(C)CC1)C1CN(C)C1
InChIInChI=1S/C13H26N2/c1-4-15(13-9-14(3)10-13)12-7-5-11(2)6-8-12/h11-13H,4-10H2,1-3H3
InChIKeySNWCOARMRWZMOX-UHFFFAOYSA-N
XLogP2.20
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine?
The IUPAC name of N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine (CID 166536648) is N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine.
What is the SMILES notation for N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine?
The canonical SMILES for N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine is CCN(C1CCC(C)CC1)C1CN(C)C1.
What is the InChIKey of N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine?
The InChIKey is SNWCOARMRWZMOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-15(13-9-14(3)10-13)12-7-5-11(2)6-8-12/h11-13H,4-10H2,1-3H3.
What are the key properties of N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine?
N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine has a molecular weight of 210.36 g/mol, XLogP of 2.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-methyl-N-(4-methylcyclohexyl)azetidin-3-amine is sourced from PubChem (CID 166536648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).