1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol

C11H20N4O — CID 107159769

IUPAC1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol
SMILESCc1nc(N)cc(NCC(O)CC(C)C)n1
InChIInChI=1S/C11H20N4O/c1-7(2)4-9(16)6-13-11-5-10(12)14-8(3)15-11/h5,7,9,16H,4,6H2,1-3H3,(H3,12,13,14,15)
InChIKeyPZOREPJFINJKQK-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.19
Rot. Bonds5

About 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol

1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol (PubChem CID 107159769) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol.

Molecular Properties

Compound Name1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol
PubChem CID107159769
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol
SMILESCc1nc(N)cc(NCC(O)CC(C)C)n1
InChIInChI=1S/C11H20N4O/c1-7(2)4-9(16)6-13-11-5-10(12)14-8(3)15-11/h5,7,9,16H,4,6H2,1-3H3,(H3,12,13,14,15)
InChIKeyPZOREPJFINJKQK-UHFFFAOYSA-N
XLogP1.19
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol with MolForge

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Related Compounds

1-[(6-hydrazinyl-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol
CID 107159886
1-[(6-amino-2-methylpyrimidin-4-yl)amino]-3-methoxypropan-2-ol
CID 80836350
2-methyl-4-N-(2-methyl-3-methylsulfanylpropyl)pyrimidine-4,6-diamine
CID 80839670
2-[(6-amino-2-methylpyrimidin-4-yl)amino]-N-propan-2-ylacetamide
CID 80793217
1-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]-4-methylpentan-2-ol
CID 107159692
1-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]-4-methylpentan-2-ol
CID 107154974
4-N-(2-methylpropyl)pyrimidine-2,4,6-triamine
CID 80770441
2-methyl-4-N-(5-methylhexan-2-yl)pyrimidine-4,6-diamine
CID 80838338
1-[(6-hydrazinyl-2-pyridinyl)amino]-4-methylpentan-2-ol
CID 107159891
3-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]propane-1,2-diol
CID 80851001
1-[(3-amino-6-methyl-2-pyridinyl)amino]-4-methylpentan-2-ol
CID 107151105
3-[(6-ethyl-2-methylpyrimidin-4-yl)amino]propane-1,2-diol
CID 66174808

Frequently Asked Questions

What is the IUPAC name of 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol?
The IUPAC name of 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol (CID 107159769) is 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol.
What is the SMILES notation for 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol?
The canonical SMILES for 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol is Cc1nc(N)cc(NCC(O)CC(C)C)n1.
What is the InChIKey of 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol?
The InChIKey is PZOREPJFINJKQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-7(2)4-9(16)6-13-11-5-10(12)14-8(3)15-11/h5,7,9,16H,4,6H2,1-3H3,(H3,12,13,14,15).
What are the key properties of 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol?
1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol has a molecular weight of 224.31 g/mol, XLogP of 1.19, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-amino-2-methylpyrimidin-4-yl)amino]-4-methylpentan-2-ol is sourced from PubChem (CID 107159769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).