N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine

C14H25N — CID 57108305

IUPACN,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine
SMILESCC1=C(C=CN(C)C)C(C)(C)CCC1C
InChIInChI=1S/C14H25N/c1-11-7-9-14(3,4)13(12(11)2)8-10-15(5)6/h8,10-11H,7,9H2,1-6H3
InChIKeyXYWFSCDHETZWJO-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.83
Rot. Bonds2

About N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine

N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine (PubChem CID 57108305) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine
PubChem CID57108305
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC NameN,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine
SMILESCC1=C(C=CN(C)C)C(C)(C)CCC1C
InChIInChI=1S/C14H25N/c1-11-7-9-14(3,4)13(12(11)2)8-10-15(5)6/h8,10-11H,7,9H2,1-6H3
InChIKeyXYWFSCDHETZWJO-UHFFFAOYSA-N
XLogP3.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine?
The IUPAC name of N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine (CID 57108305) is N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine.
What is the SMILES notation for N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine?
The canonical SMILES for N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine is CC1=C(C=CN(C)C)C(C)(C)CCC1C.
What is the InChIKey of N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine?
The InChIKey is XYWFSCDHETZWJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-11-7-9-14(3,4)13(12(11)2)8-10-15(5)6/h8,10-11H,7,9H2,1-6H3.
What are the key properties of N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine?
N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine has a molecular weight of 207.36 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2,3,6,6-tetramethylcyclohexen-1-yl)ethenamine is sourced from PubChem (CID 57108305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).