3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol

C9H14N4O — CID 102984602

IUPAC3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol
SMILESNc1nccnc1NCC1CC(O)C1
InChIInChI=1S/C9H14N4O/c10-8-9(12-2-1-11-8)13-5-6-3-7(14)4-6/h1-2,6-7,14H,3-5H2,(H2,10,11)(H,12,13)
InChIKeyJBCKCUSHQCLHDL-UHFFFAOYSA-N
MW194.24 g/mol
LogP0.24
Rot. Bonds3

About 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol

3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol (PubChem CID 102984602) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol
PubChem CID102984602
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol
SMILESNc1nccnc1NCC1CC(O)C1
InChIInChI=1S/C9H14N4O/c10-8-9(12-2-1-11-8)13-5-6-3-7(14)4-6/h1-2,6-7,14H,3-5H2,(H2,10,11)(H,12,13)
InChIKeyJBCKCUSHQCLHDL-UHFFFAOYSA-N
XLogP0.24
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-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

Related Compounds

3-[(3-hydroxycyclobutyl)methylamino]pyrazine-2-carbonitrile
CID 66005273
3-[[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 80922260
3-[[(4-amino-1-methylpyrazol-3-yl)amino]methyl]cyclobutan-1-ol
CID 103078653
3-[[[6-(ethylamino)-5-methylpyrimidin-4-yl]amino]methyl]cyclobutan-1-ol
CID 80855861
3-[[(3,5-difluoro-2-pyridinyl)amino]methyl]cyclobutan-1-ol
CID 112675958
3-[(1,3-thiazol-2-ylamino)methyl]cyclobutan-1-ol
CID 66006565
3-[[(6-chloro-5-methylpyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 66006827
3-[[[5-methyl-6-(propylamino)pyrimidin-4-yl]amino]methyl]cyclobutan-1-ol
CID 80855486
3-[[[2-(trifluoromethyl)pyrazolo[1,5-a]pyrazin-4-yl]amino]methyl]cyclobutan-1-ol
CID 104731784
3-[[(3,5,6-trichloro-2-pyridinyl)amino]methyl]cyclobutan-1-ol
CID 102751364
3-[[[2-(ethylamino)-5-methylpyrimidin-4-yl]amino]methyl]cyclobutan-1-ol
CID 80855633
3-[(4-hydroxycyclohexyl)methylamino]pyrazine-2-carboxylic acid
CID 114148596

Frequently Asked Questions

What is the IUPAC name of 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol?
The IUPAC name of 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol (CID 102984602) is 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol.
What is the SMILES notation for 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol?
The canonical SMILES for 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol is Nc1nccnc1NCC1CC(O)C1.
What is the InChIKey of 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol?
The InChIKey is JBCKCUSHQCLHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O/c10-8-9(12-2-1-11-8)13-5-6-3-7(14)4-6/h1-2,6-7,14H,3-5H2,(H2,10,11)(H,12,13).
What are the key properties of 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol?
3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol has a molecular weight of 194.24 g/mol, XLogP of 0.24, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3-aminopyrazin-2-yl)amino]methyl]cyclobutan-1-ol is sourced from PubChem (CID 102984602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).