[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol

C15H26N4O2 — CID 106301218

IUPAC[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol
SMILESCCCc1nc(NCC)cc(NC2(CO)CCOCC2)n1
InChIInChI=1S/C15H26N4O2/c1-3-5-12-17-13(16-4-2)10-14(18-12)19-15(11-20)6-8-21-9-7-15/h10,20H,3-9,11H2,1-2H3,(H2,16,17,18,19)
InChIKeyZDKTUUWMVQKDDE-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.81
Rot. Bonds7

About [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol

[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol (PubChem CID 106301218) has the molecular formula C15H26N4O2 and a molecular weight of 294.40 g/mol. Its IUPAC name is [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol
PubChem CID106301218
Molecular FormulaC15H26N4O2
Molecular Weight294.40 g/mol
Exact Mass294.21
IUPAC Name[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol
SMILESCCCc1nc(NCC)cc(NC2(CO)CCOCC2)n1
InChIInChI=1S/C15H26N4O2/c1-3-5-12-17-13(16-4-2)10-14(18-12)19-15(11-20)6-8-21-9-7-15/h10,20H,3-9,11H2,1-2H3,(H2,16,17,18,19)
InChIKeyZDKTUUWMVQKDDE-UHFFFAOYSA-N
XLogP1.81
TPSA79.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol with MolForge

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Related Compounds

[4-[(6-amino-2-propylpyrimidin-4-yl)amino]oxan-4-yl]methanol
CID 106301136
[1-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]-4-methylcyclohexyl]methanol
CID 80940619
[1-[(6-amino-2-propylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 80955109
4-[[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]methyl]oxan-4-ol
CID 81132043
[4-[(2,6-dimethylpyrimidin-4-yl)amino]oxan-4-yl]methanol
CID 114170393
[4-[(6-chloro-2-methylpyrimidin-4-yl)amino]oxan-4-yl]methanol
CID 106300524
6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine
CID 83027389
[4-[[6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]oxan-4-yl]methanol
CID 106301181
6-N-ethyl-4-N-[(3-methoxyoxolan-3-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 104767328
6-N-ethyl-4-N-(4-methyloxan-4-yl)pyrimidine-2,4,6-triamine
CID 113491377
6-N-ethyl-2-methyl-4-N-(3-methyloxolan-3-yl)pyrimidine-4,6-diamine
CID 113482400
4-N-ethyl-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80946507

Frequently Asked Questions

What is the IUPAC name of [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol?
The IUPAC name of [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol (CID 106301218) is [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol.
What is the SMILES notation for [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol?
The canonical SMILES for [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol is CCCc1nc(NCC)cc(NC2(CO)CCOCC2)n1.
What is the InChIKey of [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol?
The InChIKey is ZDKTUUWMVQKDDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O2/c1-3-5-12-17-13(16-4-2)10-14(18-12)19-15(11-20)6-8-21-9-7-15/h10,20H,3-9,11H2,1-2H3,(H2,16,17,18,19).
What are the key properties of [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol?
[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol has a molecular weight of 294.40 g/mol, XLogP of 1.81, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol is sourced from PubChem (CID 106301218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).