(2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol

C14H19N3O3 — CID 99611279

IUPAC(2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol
SMILESCCOc1cc(NC[C@@](C)(O)c2ccc(C)o2)ncn1
InChIInChI=1S/C14H19N3O3/c1-4-19-13-7-12(16-9-17-13)15-8-14(3,18)11-6-5-10(2)20-11/h5-7,9,18H,4,8H2,1-3H3,(H,15,16,17)/t14-/m1/s1
InChIKeyALZLVHQXVJMGRL-CQSZACIVSA-N
MW277.32 g/mol
LogP2.10
Rot. Bonds6

About (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol

(2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol (PubChem CID 99611279) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol
PubChem CID99611279
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name(2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol
SMILESCCOc1cc(NC[C@@](C)(O)c2ccc(C)o2)ncn1
InChIInChI=1S/C14H19N3O3/c1-4-19-13-7-12(16-9-17-13)15-8-14(3,18)11-6-5-10(2)20-11/h5-7,9,18H,4,8H2,1-3H3,(H,15,16,17)/t14-/m1/s1
InChIKeyALZLVHQXVJMGRL-CQSZACIVSA-N
XLogP2.10
TPSA80.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol with MolForge

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Related Compounds

ethyl 6-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carboxylate
CID 133353047
1-[(7-chloroquinazolin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol
CID 133353209
1-[(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol
CID 133353221
N-(5-chloro-2,2-dimethylpentyl)-6-ethoxypyrimidin-4-amine
CID 106142050
3-[[(6-ethoxypyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 66331001
6-ethoxy-N-(4,4,4-trifluorobutyl)pyrimidin-4-amine
CID 113327797
6-ethoxy-N-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-amine
CID 66328025
1-(2-ethoxy-4-fluorophenyl)-3-[2-hydroxy-2-(5-methylfuran-2-yl)propyl]urea
CID 111473863
1-[(6-methoxypyrimidin-4-yl)amino]-2-methylpentan-2-ol
CID 104917606
6-ethoxy-N-[2-(furan-2-yl)ethyl]pyrimidin-4-amine
CID 66328978
2-[[2-hydroxy-2-(5-methylfuran-2-yl)propyl]amino]pyridine-3-carbonitrile
CID 133353245
6-ethoxy-N-(4-methylhexan-2-yl)pyrimidin-4-amine
CID 66328442

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol?
The IUPAC name of (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol (CID 99611279) is (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol.
What is the SMILES notation for (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol?
The canonical SMILES for (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol is CCOc1cc(NC[C@@](C)(O)c2ccc(C)o2)ncn1.
What is the InChIKey of (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol?
The InChIKey is ALZLVHQXVJMGRL-CQSZACIVSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-4-19-13-7-12(16-9-17-13)15-8-14(3,18)11-6-5-10(2)20-11/h5-7,9,18H,4,8H2,1-3H3,(H,15,16,17)/t14-/m1/s1.
What are the key properties of (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol?
(2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol has a molecular weight of 277.32 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(6-ethoxypyrimidin-4-yl)amino]-2-(5-methylfuran-2-yl)propan-2-ol is sourced from PubChem (CID 99611279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).