N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine

C11H21N — CID 129102830

IUPACN,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine
SMILESC=C1CCC(CCN(C)C)CC1
InChIInChI=1S/C11H21N/c1-10-4-6-11(7-5-10)8-9-12(2)3/h11H,1,4-9H2,2-3H3
InChIKeyQEYRXPGPHUCZFA-UHFFFAOYSA-N
MW167.30 g/mol
LogP2.68
Rot. Bonds3

About N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine

N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine (PubChem CID 129102830) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine
PubChem CID129102830
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine
SMILESC=C1CCC(CCN(C)C)CC1
InChIInChI=1S/C11H21N/c1-10-4-6-11(7-5-10)8-9-12(2)3/h11H,1,4-9H2,2-3H3
InChIKeyQEYRXPGPHUCZFA-UHFFFAOYSA-N
XLogP2.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine (CID 129102830) is N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine is C=C1CCC(CCN(C)C)CC1.
What is the InChIKey of N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine?
The InChIKey is QEYRXPGPHUCZFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N/c1-10-4-6-11(7-5-10)8-9-12(2)3/h11H,1,4-9H2,2-3H3.
What are the key properties of N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine?
N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine has a molecular weight of 167.30 g/mol, XLogP of 2.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(4-methylidenecyclohexyl)ethanamine is sourced from PubChem (CID 129102830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).