1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol

C10H18N4O — CID 80933620

IUPAC1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
SMILESCCc1nc(NC)cc(NCC(C)O)n1
InChIInChI=1S/C10H18N4O/c1-4-8-13-9(11-3)5-10(14-8)12-6-7(2)15/h5,7,15H,4,6H2,1-3H3,(H2,11,12,13,14)
InChIKeyCPXNAPQMPVQPLM-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.87
Rot. Bonds5

About 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol

1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol (PubChem CID 80933620) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol.

Molecular Properties

Compound Name1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
PubChem CID80933620
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
SMILESCCc1nc(NC)cc(NCC(C)O)n1
InChIInChI=1S/C10H18N4O/c1-4-8-13-9(11-3)5-10(14-8)12-6-7(2)15/h5,7,15H,4,6H2,1-3H3,(H2,11,12,13,14)
InChIKeyCPXNAPQMPVQPLM-UHFFFAOYSA-N
XLogP0.87
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-[[2-tert-butyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80967240
1-[[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol
CID 80967408
4-N-[2-(dimethylamino)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine
CID 80933851
2-ethyl-N-methyl-6-propan-2-ylpyrimidin-4-amine
CID 62192702
5-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]pentan-1-ol
CID 107324238
6-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]hexan-1-ol
CID 114009544
1-[[6-(methylamino)-2-pyridinyl]amino]propan-2-ol
CID 80780222
3-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]-2,2-difluoropropan-1-ol
CID 106179311
4-N-[2-(diethylamino)ethyl]-2-ethyl-6-N-methylpyrimidine-4,6-diamine
CID 80933514
2-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]ethylurea
CID 83118223
2-ethyl-N,6-dimethylpyrimidin-4-amine
CID 62192654
N-(2-chloropropyl)-2-ethyl-6-methylpyrimidin-4-amine
CID 130512726

Frequently Asked Questions

What is the IUPAC name of 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol?
The IUPAC name of 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol (CID 80933620) is 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol.
What is the SMILES notation for 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol?
The canonical SMILES for 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol is CCc1nc(NC)cc(NCC(C)O)n1.
What is the InChIKey of 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol?
The InChIKey is CPXNAPQMPVQPLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-8-13-9(11-3)5-10(14-8)12-6-7(2)15/h5,7,15H,4,6H2,1-3H3,(H2,11,12,13,14).
What are the key properties of 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol?
1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol has a molecular weight of 210.28 g/mol, XLogP of 0.87, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-ethyl-6-(methylamino)pyrimidin-4-yl]amino]propan-2-ol is sourced from PubChem (CID 80933620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).