2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol

C14H26N4O — CID 115366534

IUPAC2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol
SMILESCNc1nc(C(C)C)nc(NCC(C)(C)CO)c1C
InChIInChI=1S/C14H26N4O/c1-9(2)11-17-12(15-6)10(3)13(18-11)16-7-14(4,5)8-19/h9,19H,7-8H2,1-6H3,(H2,15,16,17,18)
InChIKeyWAAAKVJNNQTCSW-UHFFFAOYSA-N
MW266.39 g/mol
LogP2.38
Rot. Bonds6

About 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol

2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol (PubChem CID 115366534) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol
PubChem CID115366534
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol
SMILESCNc1nc(C(C)C)nc(NCC(C)(C)CO)c1C
InChIInChI=1S/C14H26N4O/c1-9(2)11-17-12(15-6)10(3)13(18-11)16-7-14(4,5)8-19/h9,19H,7-8H2,1-6H3,(H2,15,16,17,18)
InChIKeyWAAAKVJNNQTCSW-UHFFFAOYSA-N
XLogP2.38
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 52.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol with MolForge

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Related Compounds

4-N-(2-methoxy-2-methylpropyl)-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 104767223
4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]butan-2-ol
CID 80992534
2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
CID 80981186
4-N-(2-methoxypropyl)-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 102701807
N-[2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]ethyl]acetamide
CID 80993574
1-[[6-(ethylamino)-5-methyl-2-propan-2-ylpyrimidin-4-yl]amino]-2-methylbutan-2-ol
CID 80993004
4-[[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-3,3-dimethylbutan-1-ol
CID 106149725
4-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]pentan-1-ol
CID 80992319
6-chloro-N-(2,2-dimethylpropyl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80970249
2-methyl-1-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]butan-2-ol
CID 80981087
6-ethyl-N,5-dimethyl-2-propan-2-ylpyrimidin-4-amine
CID 63560963
2-[[5-methyl-2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]ethanol
CID 80981937

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol?
The IUPAC name of 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol (CID 115366534) is 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol is CNc1nc(C(C)C)nc(NCC(C)(C)CO)c1C.
What is the InChIKey of 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol?
The InChIKey is WAAAKVJNNQTCSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-9(2)11-17-12(15-6)10(3)13(18-11)16-7-14(4,5)8-19/h9,19H,7-8H2,1-6H3,(H2,15,16,17,18).
What are the key properties of 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol?
2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol has a molecular weight of 266.39 g/mol, XLogP of 2.38, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-1-ol is sourced from PubChem (CID 115366534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).