N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine

C11H21N5 — CID 165393511

IUPACN-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine
SMILESCCNN(C)CCCCNc1cnccn1
InChIInChI=1S/C11H21N5/c1-3-15-16(2)9-5-4-6-13-11-10-12-7-8-14-11/h7-8,10,15H,3-6,9H2,1-2H3,(H,13,14)
InChIKeyYBBBTFZBHKKRJV-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.12
Rot. Bonds8

About N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine

N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine (PubChem CID 165393511) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine
PubChem CID165393511
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC NameN-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine
SMILESCCNN(C)CCCCNc1cnccn1
InChIInChI=1S/C11H21N5/c1-3-15-16(2)9-5-4-6-13-11-10-12-7-8-14-11/h7-8,10,15H,3-6,9H2,1-2H3,(H,13,14)
InChIKeyYBBBTFZBHKKRJV-UHFFFAOYSA-N
XLogP1.12
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-ethylpyrazin-2-amine
CID 145154365
N'-pyrazin-2-ylhexane-1,6-diamine
CID 107845150
N'-cyclopropyl-N'-methyl-N-pyrazin-2-ylethane-1,2-diamine
CID 62980641
1-ethyl-3-[3-(pyrazin-2-ylamino)propyl]thiourea
CID 20557740
N-(3-methylsulfinylpropyl)pyrazin-2-amine
CID 115631383
N-(3-pyrazol-1-ylpropyl)pyrazin-2-amine
CID 115580003
N-(2-methylsulfonylethyl)pyrazin-2-amine
CID 60919263
N-(3-cyclopropylpropyl)pyrazin-2-amine
CID 115637555
1,1-dimethyl-2-pyrazin-2-ylhydrazine
CID 83025719
1-ethyl-2-pyrazin-2-ylhydrazine
CID 67323447
N-but-3-ynylpyrazin-2-amine
CID 14086948
N-(2-ethoxy-2-methylpropyl)pyrazin-2-amine
CID 114942789

Frequently Asked Questions

What is the IUPAC name of N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine?
The IUPAC name of N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine (CID 165393511) is N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine.
What is the SMILES notation for N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine?
The canonical SMILES for N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine is CCNN(C)CCCCNc1cnccn1.
What is the InChIKey of N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine?
The InChIKey is YBBBTFZBHKKRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-3-15-16(2)9-5-4-6-13-11-10-12-7-8-14-11/h7-8,10,15H,3-6,9H2,1-2H3,(H,13,14).
What are the key properties of N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine?
N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine has a molecular weight of 223.32 g/mol, XLogP of 1.12, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[ethylamino(methyl)amino]butyl]pyrazin-2-amine is sourced from PubChem (CID 165393511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).