8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine

C16H26N4O — CID 80842087

IUPAC8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCCCCCOc1nc(NCCC)cn2ccnc12
InChIInChI=1S/C16H26N4O/c1-3-5-6-7-8-12-21-16-15-18-10-11-20(15)13-14(19-16)17-9-4-2/h10-11,13,17H,3-9,12H2,1-2H3
InChIKeyHUTOZQJHAPVWQU-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.90
Rot. Bonds10

About 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine

8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine (PubChem CID 80842087) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine.

Molecular Properties

Compound Name8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
PubChem CID80842087
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
SMILESCCCCCCCOc1nc(NCCC)cn2ccnc12
InChIInChI=1S/C16H26N4O/c1-3-5-6-7-8-12-21-16-15-18-10-11-20(15)13-14(19-16)17-9-4-2/h10-11,13,17H,3-9,12H2,1-2H3
InChIKeyHUTOZQJHAPVWQU-UHFFFAOYSA-N
XLogP3.90
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

8-(2-ethoxyethoxy)-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80859285
(8-hexoxyimidazo[1,2-a]pyrazin-6-yl)hydrazine
CID 80909859
8-heptoxyimidazo[1,2-a]pyrazin-6-amine
CID 80861684
8-phenylmethoxy-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80843965
N-ethyl-8-(4-methylpentoxy)imidazo[1,2-a]pyrazin-6-amine
CID 80862180
8-(3-fluorophenoxy)-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80865058
6-N-ethyl-8-N-hexylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80835650
8-N-(2-propan-2-yloxyethyl)-6-N-propylimidazo[1,2-a]pyrazine-6,8-diamine
CID 104767136
8-(oxolan-3-ylmethoxy)-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80872799
8-tert-butylsulfanyl-N-propylimidazo[1,2-a]pyrazin-6-amine
CID 80887812
6-N,8-N,8-N-tripropylimidazo[1,2-a]pyrazine-6,8-diamine
CID 80764672
N-ethyl-8-(3-methylbut-3-enoxy)imidazo[1,2-a]pyrazin-6-amine
CID 114471238

Frequently Asked Questions

What is the IUPAC name of 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine?
The IUPAC name of 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine (CID 80842087) is 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine.
What is the SMILES notation for 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine?
The canonical SMILES for 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine is CCCCCCCOc1nc(NCCC)cn2ccnc12.
What is the InChIKey of 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine?
The InChIKey is HUTOZQJHAPVWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-3-5-6-7-8-12-21-16-15-18-10-11-20(15)13-14(19-16)17-9-4-2/h10-11,13,17H,3-9,12H2,1-2H3.
What are the key properties of 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine?
8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine has a molecular weight of 290.41 g/mol, XLogP of 3.90, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-heptoxy-N-propylimidazo[1,2-a]pyrazin-6-amine is sourced from PubChem (CID 80842087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).