4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol

C14H26N4O — CID 80992319

IUPAC4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol
SMILESCNc1nc(C(C)C)nc(NC(C)CCCO)c1C
InChIInChI=1S/C14H26N4O/c1-9(2)12-17-13(15-5)11(4)14(18-12)16-10(3)7-6-8-19/h9-10,19H,6-8H2,1-5H3,(H2,15,16,17,18)
InChIKeyQSVPCXGYUJAIBM-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.52
Rot. Bonds7

About 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol

4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol (PubChem CID 80992319) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol.

Molecular Properties

Compound Name4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol
PubChem CID80992319
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol
SMILESCNc1nc(C(C)C)nc(NC(C)CCCO)c1C
InChIInChI=1S/C14H26N4O/c1-9(2)12-17-13(15-5)11(4)14(18-12)16-10(3)7-6-8-19/h9-10,19H,6-8H2,1-5H3,(H2,15,16,17,18)
InChIKeyQSVPCXGYUJAIBM-UHFFFAOYSA-N
XLogP2.52
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol with MolForge

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Related Compounds

4-[(6-chloro-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]pentan-1-ol
CID 80978575
4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
CID 80992975
3-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]butan-1-ol
CID 83179481
4-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]pentan-1-ol
CID 80926849
4-N-hexan-2-yl-5-methyl-2-propan-2-yl-6-N-propylpyrimidine-4,6-diamine
CID 80984973
4-[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]pentan-1-ol
CID 80852682
2-[(6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]propan-1-ol
CID 80995792
4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]butan-2-ol
CID 80992534
2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol
CID 115366534
4-N-(1-imidazol-1-ylpropan-2-yl)-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80985899
3-[[5-methyl-6-(methylamino)pyrimidin-4-yl]amino]butan-1-ol
CID 83179964
2-[methyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]ethanol
CID 80980902

Frequently Asked Questions

What is the IUPAC name of 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol?
The IUPAC name of 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol (CID 80992319) is 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol.
What is the SMILES notation for 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol?
The canonical SMILES for 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol is CNc1nc(C(C)C)nc(NC(C)CCCO)c1C.
What is the InChIKey of 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol?
The InChIKey is QSVPCXGYUJAIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-9(2)12-17-13(15-5)11(4)14(18-12)16-10(3)7-6-8-19/h9-10,19H,6-8H2,1-5H3,(H2,15,16,17,18).
What are the key properties of 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol?
4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol has a molecular weight of 266.39 g/mol, XLogP of 2.52, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol is sourced from PubChem (CID 80992319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).