2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol

C13H24N4O — CID 64789490

IUPAC2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol
SMILESCC(N)(CO)CCCCN1CCn2ccnc2C1
InChIInChI=1S/C13H24N4O/c1-13(14,11-18)4-2-3-6-16-8-9-17-7-5-15-12(17)10-16/h5,7,18H,2-4,6,8-11,14H2,1H3
InChIKeyWBSVBTYWRKGYSP-UHFFFAOYSA-N
MW252.36 g/mol
LogP0.58
Rot. Bonds6

About 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol

2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol (PubChem CID 64789490) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol.

Molecular Properties

Compound Name2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol
PubChem CID64789490
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol
SMILESCC(N)(CO)CCCCN1CCn2ccnc2C1
InChIInChI=1S/C13H24N4O/c1-13(14,11-18)4-2-3-6-16-8-9-17-7-5-15-12(17)10-16/h5,7,18H,2-4,6,8-11,14H2,1H3
InChIKeyWBSVBTYWRKGYSP-UHFFFAOYSA-N
XLogP0.58
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol?
The IUPAC name of 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol (CID 64789490) is 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol.
What is the SMILES notation for 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol?
The canonical SMILES for 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol is CC(N)(CO)CCCCN1CCn2ccnc2C1.
What is the InChIKey of 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol?
The InChIKey is WBSVBTYWRKGYSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-13(14,11-18)4-2-3-6-16-8-9-17-7-5-15-12(17)10-16/h5,7,18H,2-4,6,8-11,14H2,1H3.
What are the key properties of 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol?
2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol has a molecular weight of 252.36 g/mol, XLogP of 0.58, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-methylhexan-1-ol is sourced from PubChem (CID 64789490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).