1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine

C14H29N3 — CID 104746257

IUPAC1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine
SMILESCNC(CN1CCN(C)C(C)C1)C1CCCC1
InChIInChI=1S/C14H29N3/c1-12-10-17(9-8-16(12)3)11-14(15-2)13-6-4-5-7-13/h12-15H,4-11H2,1-3H3
InChIKeyQILVEVXJNAKPBG-UHFFFAOYSA-N
MW239.41 g/mol
LogP1.40
Rot. Bonds4

About 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine

1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine (PubChem CID 104746257) has the molecular formula C14H29N3 and a molecular weight of 239.41 g/mol. Its IUPAC name is 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine
PubChem CID104746257
Molecular FormulaC14H29N3
Molecular Weight239.41 g/mol
Exact Mass239.24
IUPAC Name1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine
SMILESCNC(CN1CCN(C)C(C)C1)C1CCCC1
InChIInChI=1S/C14H29N3/c1-12-10-17(9-8-16(12)3)11-14(15-2)13-6-4-5-7-13/h12-15H,4-11H2,1-3H3
InChIKeyQILVEVXJNAKPBG-UHFFFAOYSA-N
XLogP1.40
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 ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethyl-2-methylpiperidine
CID 7727
2,4,6-Trimethylpiperidine
CID 89562
N-(cyclohexylmethyl)-1-ethylpiperidin-4-amine
CID 2846481
1-(4-Methyl-cyclohexyl)-piperazinehydrochloride
CID 16188159
6-Methyl-6,9-diazaspiro[4.5]decane
CID 28901865
9-Methyl-6,9-diazaspiro[4.5]decane
CID 52416411
3-(1-Methylpyrrolidin-2-yl)piperidine
CID 219458
1-(Cyclohexylmethyl)piperazine
CID 2735885
(R)-N2-(2-cyclopentylethyl)-N1-((R)-1-(methylamino)pentan-2-yl)pentane-1,2-diamine
CID 45482209
(2S,3S)-2-((R)-4-(3-cyclohexylpropyl)-3-isopropylpiperazin-1-yl)-N,3-dimethylpentan-1-amine
CID 45482257
6,9-Diazaspiro[4.5]decane
CID 18975279
2-(1,4-Dimethylpiperazin-2-yl)-3-methylpentan-1-amine
CID 3052885

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine?
The IUPAC name of 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine (CID 104746257) is 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine.
What is the SMILES notation for 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine?
The canonical SMILES for 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine is CNC(CN1CCN(C)C(C)C1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine?
The InChIKey is QILVEVXJNAKPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3/c1-12-10-17(9-8-16(12)3)11-14(15-2)13-6-4-5-7-13/h12-15H,4-11H2,1-3H3.
What are the key properties of 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine?
1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine has a molecular weight of 239.41 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-(3,4-dimethylpiperazin-1-yl)-N-methylethanamine is sourced from PubChem (CID 104746257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).