N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine

C15H24N4 — CID 81249841

IUPACN-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine
SMILESCCN1CCN(c2ccncc2CNC2CC2)CC1
InChIInChI=1S/C15H24N4/c1-2-18-7-9-19(10-8-18)15-5-6-16-11-13(15)12-17-14-3-4-14/h5-6,11,14,17H,2-4,7-10,12H2,1H3
InChIKeyFLRPIRONJKDXEX-UHFFFAOYSA-N
MW260.38 g/mol
LogP1.48
Rot. Bonds5

About N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine

N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine (PubChem CID 81249841) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine
PubChem CID81249841
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC NameN-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine
SMILESCCN1CCN(c2ccncc2CNC2CC2)CC1
InChIInChI=1S/C15H24N4/c1-2-18-7-9-19(10-8-18)15-5-6-16-11-13(15)12-17-14-3-4-14/h5-6,11,14,17H,2-4,7-10,12H2,1H3
InChIKeyFLRPIRONJKDXEX-UHFFFAOYSA-N
XLogP1.48
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine (CID 81249841) is N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine is CCN1CCN(c2ccncc2CNC2CC2)CC1.
What is the InChIKey of N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine?
The InChIKey is FLRPIRONJKDXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-2-18-7-9-19(10-8-18)15-5-6-16-11-13(15)12-17-14-3-4-14/h5-6,11,14,17H,2-4,7-10,12H2,1H3.
What are the key properties of N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine?
N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine has a molecular weight of 260.38 g/mol, XLogP of 1.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(4-ethylpiperazin-1-yl)-3-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 81249841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).