N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine

C14H29N3 — CID 63620690

IUPACN-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine
SMILESCN1CCN(CCNC2CCCC2)CC1(C)C
InChIInChI=1S/C14H29N3/c1-14(2)12-17(11-10-16(14)3)9-8-15-13-6-4-5-7-13/h13,15H,4-12H2,1-3H3
InChIKeyAGQLCCLLTKEWEF-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.54
Rot. Bonds4

About N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine

N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine (PubChem CID 63620690) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine
PubChem CID63620690
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC NameN-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine
SMILESCN1CCN(CCNC2CCCC2)CC1(C)C
InChIInChI=1S/C14H29N3/c1-14(2)12-17(11-10-16(14)3)9-8-15-13-6-4-5-7-13/h13,15H,4-12H2,1-3H3
InChIKeyAGQLCCLLTKEWEF-UHFFFAOYSA-N
XLogP1.54
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.41
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(3,3,4-trimethylpiperazin-1-yl)propyl]cyclopentanamine
CID 63619496
N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]oxan-4-amine
CID 63620851
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclopentanamine
CID 60701361
N-[2-(4,4-dimethylpiperidin-1-yl)ethyl]cycloheptanamine
CID 62932033
N-[2-(4-methylpiperazin-1-yl)ethyl]cyclohexanamine
CID 60701363
N-[2-(4-methyl-1,4-diazepan-1-yl)ethyl]cyclooctanamine
CID 71383118
1-cyclopropyl-N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]ethanamine
CID 63620008
N-(2-pyrrolidin-1-ylethyl)cyclohexanamine
CID 43181622
N-[2-(4,4-dimethylazepan-1-yl)ethyl]cycloheptanamine
CID 65286769
1-[2-(cyclopropylamino)ethyl]-3-methylpyrrolidin-3-ol
CID 103357909
N-[2-(3-ethyl-4-methylpiperazin-1-yl)ethyl]cycloheptanamine
CID 55217199
1-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]azepan-4-amine
CID 65070783

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine?
The IUPAC name of N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine (CID 63620690) is N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine?
The canonical SMILES for N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine is CN1CCN(CCNC2CCCC2)CC1(C)C.
What is the InChIKey of N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine?
The InChIKey is AGQLCCLLTKEWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-14(2)12-17(11-10-16(14)3)9-8-15-13-6-4-5-7-13/h13,15H,4-12H2,1-3H3.
What are the key properties of N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine?
N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine has a molecular weight of 239.41 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,3,4-trimethylpiperazin-1-yl)ethyl]cyclopentanamine is sourced from PubChem (CID 63620690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).