5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine

C14H26N4 — CID 3804270

IUPAC5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine
SMILESNCCCCCc1cnc(CCCCCN)cn1
InChIInChI=1S/C14H26N4/c15-9-5-1-3-7-13-11-18-14(12-17-13)8-4-2-6-10-16/h11-12H,1-10,15-16H2
InChIKeyQXRQWTNFCZBRQD-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.82
Rot. Bonds10

About 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine

5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine (PubChem CID 3804270) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine.

Molecular Properties

Compound Name5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine
PubChem CID3804270
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine
SMILESNCCCCCc1cnc(CCCCCN)cn1
InChIInChI=1S/C14H26N4/c15-9-5-1-3-7-13-11-18-14(12-17-13)8-4-2-6-10-16/h11-12H,1-10,15-16H2
InChIKeyQXRQWTNFCZBRQD-UHFFFAOYSA-N
XLogP1.82
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine?
The IUPAC name of 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine (CID 3804270) is 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine.
What is the SMILES notation for 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine?
The canonical SMILES for 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine is NCCCCCc1cnc(CCCCCN)cn1.
What is the InChIKey of 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine?
The InChIKey is QXRQWTNFCZBRQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c15-9-5-1-3-7-13-11-18-14(12-17-13)8-4-2-6-10-16/h11-12H,1-10,15-16H2.
What are the key properties of 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine?
5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine has a molecular weight of 250.39 g/mol, XLogP of 1.82, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(5-aminopentyl)pyrazin-2-yl]pentan-1-amine is sourced from PubChem (CID 3804270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).