6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine

C16H34N4 — CID 79829186

IUPAC6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine
SMILESCN(C)CCN1CCN(C2CCCC(C)(C)C2N)CC1
InChIInChI=1S/C16H34N4/c1-16(2)7-5-6-14(15(16)17)20-12-10-19(11-13-20)9-8-18(3)4/h14-15H,5-13,17H2,1-4H3
InChIKeyCSDCYDBZJJDDAN-UHFFFAOYSA-N
MW282.48 g/mol
LogP1.07
Rot. Bonds4

About 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine

6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine (PubChem CID 79829186) has the molecular formula C16H34N4 and a molecular weight of 282.48 g/mol. Its IUPAC name is 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine
PubChem CID79829186
Molecular FormulaC16H34N4
Molecular Weight282.48 g/mol
Exact Mass282.28
IUPAC Name6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine
SMILESCN(C)CCN1CCN(C2CCCC(C)(C)C2N)CC1
InChIInChI=1S/C16H34N4/c1-16(2)7-5-6-14(15(16)17)20-12-10-19(11-13-20)9-8-18(3)4/h14-15H,5-13,17H2,1-4H3
InChIKeyCSDCYDBZJJDDAN-UHFFFAOYSA-N
XLogP1.07
TPSA35.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.48
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine?
The IUPAC name of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine (CID 79829186) is 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine.
What is the SMILES notation for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine?
The canonical SMILES for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine is CN(C)CCN1CCN(C2CCCC(C)(C)C2N)CC1.
What is the InChIKey of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine?
The InChIKey is CSDCYDBZJJDDAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N4/c1-16(2)7-5-6-14(15(16)17)20-12-10-19(11-13-20)9-8-18(3)4/h14-15H,5-13,17H2,1-4H3.
What are the key properties of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine?
6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine has a molecular weight of 282.48 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2,2-dimethylcyclohexan-1-amine is sourced from PubChem (CID 79829186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).