N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine

C15H25N5 — CID 107379247

IUPACN-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
SMILESCC(C)N1CCN(c2cnc(CNC3CC3)cn2)CC1
InChIInChI=1S/C15H25N5/c1-12(2)19-5-7-20(8-6-19)15-11-17-14(10-18-15)9-16-13-3-4-13/h10-13,16H,3-9H2,1-2H3
InChIKeyUYKMJRBJJZMJLU-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.26
Rot. Bonds5

About N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine

N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine (PubChem CID 107379247) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
PubChem CID107379247
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine
SMILESCC(C)N1CCN(c2cnc(CNC3CC3)cn2)CC1
InChIInChI=1S/C15H25N5/c1-12(2)19-5-7-20(8-6-19)15-11-17-14(10-18-15)9-16-13-3-4-13/h10-13,16H,3-9H2,1-2H3
InChIKeyUYKMJRBJJZMJLU-UHFFFAOYSA-N
XLogP1.26
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine (CID 107379247) is N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine is CC(C)N1CCN(c2cnc(CNC3CC3)cn2)CC1.
What is the InChIKey of N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
The InChIKey is UYKMJRBJJZMJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-12(2)19-5-7-20(8-6-19)15-11-17-14(10-18-15)9-16-13-3-4-13/h10-13,16H,3-9H2,1-2H3.
What are the key properties of N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine?
N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine has a molecular weight of 275.40 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 107379247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).