5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine

C15H33N3 — CID 63608601

IUPAC5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine
SMILESCCCNC(C)CCCN1CCN(C)C(CC)C1
InChIInChI=1S/C15H33N3/c1-5-9-16-14(3)8-7-10-18-12-11-17(4)15(6-2)13-18/h14-16H,5-13H2,1-4H3
InChIKeyAHHGIMONTVRXKE-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.18
Rot. Bonds8

About 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine

5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine (PubChem CID 63608601) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine.

Molecular Properties

Compound Name5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine
PubChem CID63608601
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC Name5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine
SMILESCCCNC(C)CCCN1CCN(C)C(CC)C1
InChIInChI=1S/C15H33N3/c1-5-9-16-14(3)8-7-10-18-12-11-17(4)15(6-2)13-18/h14-16H,5-13H2,1-4H3
InChIKeyAHHGIMONTVRXKE-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-ethyl-4-methylpiperazin-1-yl)-N-methylpentan-2-amine
CID 63611231
5-(3-ethyl-4-methylpiperazin-1-yl)pentan-2-amine
CID 63608603
N-[3-(3-ethyl-4-methylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
CID 63611055
N-propyl-5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114537915
N-propyl-6-(3,3,4-trimethylpiperazin-1-yl)hexan-2-amine
CID 63611239
6-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-propylhexan-2-amine
CID 63151141
methyl 3-(3-ethyl-4-methylpiperazin-1-yl)-2-(propylamino)propanoate
CID 63633851
4-(4-bromobutyl)-2-ethyl-1-methylpiperazine
CID 63636075
5-(3-morpholin-4-ylpyrrolidin-1-yl)-N-propylpentan-2-amine
CID 63169783
4-(6-chlorohexyl)-2-ethyl-1-methylpiperazine
CID 63635899
6-(aziridin-1-yl)-4-methyl-N-propylhexan-2-amine
CID 167270621
(2S)-1-(3-ethyl-4-methylpiperazin-1-yl)propan-2-amine
CID 103934660

Frequently Asked Questions

What is the IUPAC name of 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine?
The IUPAC name of 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine (CID 63608601) is 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine.
What is the SMILES notation for 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine?
The canonical SMILES for 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine is CCCNC(C)CCCN1CCN(C)C(CC)C1.
What is the InChIKey of 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine?
The InChIKey is AHHGIMONTVRXKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-5-9-16-14(3)8-7-10-18-12-11-17(4)15(6-2)13-18/h14-16H,5-13H2,1-4H3.
What are the key properties of 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine?
5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine has a molecular weight of 255.45 g/mol, XLogP of 2.18, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethyl-4-methylpiperazin-1-yl)-N-propylpentan-2-amine is sourced from PubChem (CID 63608601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).