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

C14H24N4O — CID 80992975

IUPAC4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
SMILESCNc1nc(C2CC2)nc(NC(C)CCCO)c1C
InChIInChI=1S/C14H24N4O/c1-9(5-4-8-19)16-13-10(2)12(15-3)17-14(18-13)11-6-7-11/h9,11,19H,4-8H2,1-3H3,(H2,15,16,17,18)
InChIKeyIAEITYRBNJYITF-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.28
Rot. Bonds7

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

4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol (PubChem CID 80992975) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol.

Molecular Properties

Compound Name4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
PubChem CID80992975
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
SMILESCNc1nc(C2CC2)nc(NC(C)CCCO)c1C
InChIInChI=1S/C14H24N4O/c1-9(5-4-8-19)16-13-10(2)12(15-3)17-14(18-13)11-6-7-11/h9,11,19H,4-8H2,1-3H3,(H2,15,16,17,18)
InChIKeyIAEITYRBNJYITF-UHFFFAOYSA-N
XLogP2.28
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

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Related Compounds

4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol
CID 80992319
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
3-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-2-methylpropane-1,2-diol
CID 80992851
4-[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]pentan-1-ol
CID 80852682
4-N-butan-2-yl-2-cyclopropyl-5-methylpyrimidine-4,6-diamine
CID 80980857
3-[1-[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]pyrrolidin-2-yl]propan-1-ol
CID 80985147
2-cyclopropyl-N,5-dimethyl-6-propan-2-yloxypyrimidin-4-amine
CID 80988574
2-cyclopropyl-6-N,5-dimethyl-4-N-(1-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80983342
2-cyclopropyl-6-N,5-dimethyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80984821
4-[(6-chloro-5-methyl-2-propan-2-ylpyrimidin-4-yl)amino]pentan-1-ol
CID 80978575
2-[cyclopropyl-[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]ethanol
CID 80983019

Frequently Asked Questions

What is the IUPAC name of 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol?
The IUPAC name of 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol (CID 80992975) is 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol.
What is the SMILES notation for 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol?
The canonical SMILES for 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol is CNc1nc(C2CC2)nc(NC(C)CCCO)c1C.
What is the InChIKey of 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol?
The InChIKey is IAEITYRBNJYITF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-9(5-4-8-19)16-13-10(2)12(15-3)17-14(18-13)11-6-7-11/h9,11,19H,4-8H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol?
4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol has a molecular weight of 264.37 g/mol, XLogP of 2.28, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-cyclopropyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol is sourced from PubChem (CID 80992975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).