2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine

C14H29N3 — CID 63634441

IUPAC2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine
SMILESCCN1CCN(CC2CCCCC2N)CC1C
InChIInChI=1S/C14H29N3/c1-3-17-9-8-16(10-12(17)2)11-13-6-4-5-7-14(13)15/h12-14H,3-11,15H2,1-2H3
InChIKeyVILWHRXVUDZSRL-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.53
Rot. Bonds3

About 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine

2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine (PubChem CID 63634441) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine
PubChem CID63634441
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine
SMILESCCN1CCN(CC2CCCCC2N)CC1C
InChIInChI=1S/C14H29N3/c1-3-17-9-8-16(10-12(17)2)11-13-6-4-5-7-14(13)15/h12-14H,3-11,15H2,1-2H3
InChIKeyVILWHRXVUDZSRL-UHFFFAOYSA-N
XLogP1.53
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-ethylpiperazin-1-yl)methyl]cycloheptan-1-amine
CID 62614630
2-(4-ethyl-3-methylpiperazin-1-yl)cyclohexan-1-amine
CID 63610861
2-[(3-methylpyrrolidin-1-yl)methyl]cyclohexan-1-amine
CID 62615480
1-ethyl-2-methyl-4-[[(2R)-pyrrolidin-2-yl]methyl]piperazine
CID 102819534
1-ethyl-2-methyl-4-(pyrrolidin-2-ylmethyl)piperazine
CID 63609006
ethane;(2S)-1-ethyl-2-methyl-4-[(1-methylpiperidin-4-yl)methyl]piperazine
CID 165138024
4-ethyl-2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-ol
CID 63619575
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-ylmethyl)cycloheptan-1-amine
CID 79924657
2-[2-(4-ethyl-3-methylpiperazin-1-yl)ethyl]-N-methylcyclopentan-1-amine
CID 79565848
1-cyclohexyl-2-(4-ethyl-3-methylpiperazin-1-yl)ethanone
CID 104750771
N-[3-(4-ethyl-3-methylpiperazin-1-yl)propyl]cyclopentanamine
CID 63619488
2-[(2-ethylmorpholin-4-yl)methyl]cyclohexan-1-amine
CID 62614413

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine?
The IUPAC name of 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine (CID 63634441) is 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine.
What is the SMILES notation for 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine?
The canonical SMILES for 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine is CCN1CCN(CC2CCCCC2N)CC1C.
What is the InChIKey of 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine?
The InChIKey is VILWHRXVUDZSRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-3-17-9-8-16(10-12(17)2)11-13-6-4-5-7-14(13)15/h12-14H,3-11,15H2,1-2H3.
What are the key properties of 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine?
2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine has a molecular weight of 239.41 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethyl-3-methylpiperazin-1-yl)methyl]cyclohexan-1-amine is sourced from PubChem (CID 63634441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).