3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol

C9H11BrN4O — CID 84712888

IUPAC3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol
SMILESNCCC(O)c1nccn2c(Br)cnc12
InChIInChI=1S/C9H11BrN4O/c10-7-5-13-9-8(6(15)1-2-11)12-3-4-14(7)9/h3-6,15H,1-2,11H2
InChIKeySQIZTNBPEASNIL-UHFFFAOYSA-N
MW271.12 g/mol
LogP0.87
Rot. Bonds3

About 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol

3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol (PubChem CID 84712888) has the molecular formula C9H11BrN4O and a molecular weight of 271.12 g/mol. Its IUPAC name is 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol.

Molecular Properties

Compound Name3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol
PubChem CID84712888
Molecular FormulaC9H11BrN4O
Molecular Weight271.12 g/mol
Exact Mass270.01
IUPAC Name3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol
SMILESNCCC(O)c1nccn2c(Br)cnc12
InChIInChI=1S/C9H11BrN4O/c10-7-5-13-9-8(6(15)1-2-11)12-3-4-14(7)9/h3-6,15H,1-2,11H2
InChIKeySQIZTNBPEASNIL-UHFFFAOYSA-N
XLogP0.87
TPSA76.44 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.12
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-bromoimidazo[1,2-a]pyrazin-8-yl)acetic acid
CID 84708658
3-bromo-8-ethoxyimidazo[1,2-a]pyrazine
CID 10060274
3-bromo-N-propan-2-ylimidazo[1,2-a]pyrazin-8-amine
CID 21070914
3-amino-1-(3-fluoro-2-pyridinyl)propan-1-ol
CID 84653760
(3-bromoimidazo[1,2-a]pyridin-8-yl)methanamine
CID 82618151
(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol
CID 96734232
3-amino-1-(3-chloro-8-methylimidazo[1,2-a]pyridin-2-yl)propan-1-ol
CID 84701593
(3-bromo-8-fluoroimidazo[1,2-a]pyridin-7-yl)methanol
CID 130065270
3-amino-1-(5-chloro-3-methyl-2-pyridinyl)propan-1-ol
CID 84669773
2-amino-2-(3-bromoimidazo[1,2-a]pyridin-8-yl)acetic acid
CID 83844833
3-amino-1-(3-bromo-5-methyl-4-pyridinyl)propan-1-ol
CID 84704910
3-amino-1-(1,2-thiazol-4-yl)propan-1-ol
CID 165446454

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol?
The IUPAC name of 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol (CID 84712888) is 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol.
What is the SMILES notation for 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol?
The canonical SMILES for 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol is NCCC(O)c1nccn2c(Br)cnc12.
What is the InChIKey of 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol?
The InChIKey is SQIZTNBPEASNIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrN4O/c10-7-5-13-9-8(6(15)1-2-11)12-3-4-14(7)9/h3-6,15H,1-2,11H2.
What are the key properties of 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol?
3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol has a molecular weight of 271.12 g/mol, XLogP of 0.87, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(3-bromoimidazo[1,2-a]pyrazin-8-yl)propan-1-ol is sourced from PubChem (CID 84712888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).