3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol

C10H16N4O — CID 80856009

IUPAC3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol
SMILESCNc1nc(C)cc(NC2CC(O)C2)n1
InChIInChI=1S/C10H16N4O/c1-6-3-9(14-10(11-2)12-6)13-7-4-8(15)5-7/h3,7-8,15H,4-5H2,1-2H3,(H2,11,12,13,14)
InChIKeyUOLDSMMDRAKNIJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.76
Rot. Bonds3

About 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol

3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol (PubChem CID 80856009) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol.

Molecular Properties

Compound Name3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol
PubChem CID80856009
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol
SMILESCNc1nc(C)cc(NC2CC(O)C2)n1
InChIInChI=1S/C10H16N4O/c1-6-3-9(14-10(11-2)12-6)13-7-4-8(15)5-7/h3,7-8,15H,4-5H2,1-2H3,(H2,11,12,13,14)
InChIKeyUOLDSMMDRAKNIJ-UHFFFAOYSA-N
XLogP0.76
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol with MolForge

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Related Compounds

4-N-cyclopropyl-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80769558
2-N,6-dimethyl-4-N-(4-methylcyclohexyl)pyrimidine-2,4-diamine
CID 80772502
4-N-(2,4-dimethylcyclohexyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80835388
2-N,6-dimethyl-4-N-(2,2,3,3-tetramethylcyclopropyl)pyrimidine-2,4-diamine
CID 80848684
2-N,6-dimethyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80797834
2-[(3-hydroxycyclobutyl)amino]-6-methylpyrimidine-4-carboxylic acid
CID 107554123
3-[[6-methyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]cyclobutan-1-ol
CID 103328691
3-[[6-(methylamino)-4-nitro-2-pyridinyl]amino]cyclobutan-1-ol
CID 114071210
3-[(6-methoxy-2-methylpyrimidin-4-yl)amino]cyclobutan-1-ol
CID 66326324
2-N,6-dimethyl-4-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]pyrimidine-2,4-diamine
CID 135114364
2-N-methyl-4-N-(3-methylcyclobutyl)-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114565796
N-cyclobutyl-2-hydrazinyl-6-methylpyrimidin-4-amine
CID 80919275

Frequently Asked Questions

What is the IUPAC name of 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol?
The IUPAC name of 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol (CID 80856009) is 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol.
What is the SMILES notation for 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol?
The canonical SMILES for 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol is CNc1nc(C)cc(NC2CC(O)C2)n1.
What is the InChIKey of 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol?
The InChIKey is UOLDSMMDRAKNIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-3-9(14-10(11-2)12-6)13-7-4-8(15)5-7/h3,7-8,15H,4-5H2,1-2H3,(H2,11,12,13,14).
What are the key properties of 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol?
3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol has a molecular weight of 208.26 g/mol, XLogP of 0.76, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[6-methyl-2-(methylamino)pyrimidin-4-yl]amino]cyclobutan-1-ol is sourced from PubChem (CID 80856009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).