N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine

C15H31N3 — CID 83043627

IUPACN-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)N1CCN(CCC)CC1
InChIInChI=1S/C15H31N3/c1-3-5-15(13-16-14-6-7-14)18-11-9-17(8-4-2)10-12-18/h14-16H,3-13H2,1-2H3
InChIKeyALXDCVAJMSPBHP-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.93
Rot. Bonds8

About N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine

N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine (PubChem CID 83043627) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine
PubChem CID83043627
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine
SMILESCCCC(CNC1CC1)N1CCN(CCC)CC1
InChIInChI=1S/C15H31N3/c1-3-5-15(13-16-14-6-7-14)18-11-9-17(8-4-2)10-12-18/h14-16H,3-13H2,1-2H3
InChIKeyALXDCVAJMSPBHP-UHFFFAOYSA-N
XLogP1.93
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-methylpyrrolidin-1-yl)pentyl]cyclopropanamine
CID 83054279
N-[2-(4-ethyl-4-methylpiperidin-1-yl)pentyl]cyclopropanamine
CID 83054777
N-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)pentyl]cyclopropanamine
CID 83053975
N-[2-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)pentyl]cyclopropanamine
CID 83054427
N-[4-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine
CID 56828316
N-[2-[4-(2-methylpropyl)piperazin-1-yl]butyl]cyclopropanamine
CID 62778203
N-[4-(4-propylpiperazin-1-yl)butyl]cyclopropanamine
CID 62424326
N-[2-(azocan-1-yl)butyl]cyclopropanamine
CID 62419227
N-(2-methylsulfinylpropyl)-1-propylpiperidin-4-amine
CID 115901563
N-[2-(4-tert-butyl-3,6-dihydro-2H-pyridin-1-yl)pentyl]cyclopropanamine
CID 114460805
N-[2-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)pentyl]cyclopropanamine
CID 83055066
N-[3-methoxy-2-[4-(2-methylpropyl)piperazin-1-yl]propyl]cyclopropanamine
CID 103226330

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine?
The IUPAC name of N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine (CID 83043627) is N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine.
What is the SMILES notation for N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine?
The canonical SMILES for N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine is CCCC(CNC1CC1)N1CCN(CCC)CC1.
What is the InChIKey of N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine?
The InChIKey is ALXDCVAJMSPBHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-3-5-15(13-16-14-6-7-14)18-11-9-17(8-4-2)10-12-18/h14-16H,3-13H2,1-2H3.
What are the key properties of N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine?
N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine has a molecular weight of 253.43 g/mol, XLogP of 1.93, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-propylpiperazin-1-yl)pentyl]cyclopropanamine is sourced from PubChem (CID 83043627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).