3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol

C10H17N3O2 — CID 112635479

IUPAC3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol
SMILESCCOc1cc(C)nc(C(CN)CO)n1
InChIInChI=1S/C10H17N3O2/c1-3-15-9-4-7(2)12-10(13-9)8(5-11)6-14/h4,8,14H,3,5-6,11H2,1-2H3
InChIKeyRCSUWCDMWBQPNF-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.22
Rot. Bonds5

About 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol

3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol (PubChem CID 112635479) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol
PubChem CID112635479
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol
SMILESCCOc1cc(C)nc(C(CN)CO)n1
InChIInChI=1S/C10H17N3O2/c1-3-15-9-4-7(2)12-10(13-9)8(5-11)6-14/h4,8,14H,3,5-6,11H2,1-2H3
InChIKeyRCSUWCDMWBQPNF-UHFFFAOYSA-N
XLogP0.22
TPSA81.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-[(4-ethoxy-6-methylpyrimidin-2-yl)amino]-3-methylbutan-1-ol
CID 114982569
diethyl 2-(4-methoxy-6-methylpyrimidin-2-yl)propanedioate
CID 104573497
ethyl 2-(4-ethoxy-6-methylpyrimidin-2-yl)sulfanylacetate
CID 4283909
3-amino-2-(2-methoxy-4,5-dimethylphenyl)propan-1-ol
CID 82283929
N-(4-ethoxy-6-methylpyrimidin-2-yl)-2-methylbutane-1,4-diamine
CID 112635894
4-[(4-ethoxy-6-methylpyrimidin-2-yl)amino]butan-1-ol
CID 106842653
3-amino-2-(6-methoxy-2-methylpyrimidin-4-yl)propan-1-ol
CID 66331263
4-ethoxy-6-methyl-N-(2-methylsulfanylethyl)pyrimidin-2-amine
CID 112637746
N-(2-chloropropyl)-4-ethoxy-6-methylpyrimidin-2-amine
CID 112635580
ethane;4-ethoxy-2-ethyl-6-methylpyrimidine;propane;bis(trihydroxy(sulfanylidene)-λ5-phosphane)
CID 173416409
2-(2,6-dimethyl-4-pyridinyl)butan-1-amine
CID 82409825
1-[1-(4-ethoxy-6-methylpyrimidin-2-yl)piperidin-4-yl]ethanamine
CID 112634894

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol?
The IUPAC name of 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol (CID 112635479) is 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol.
What is the SMILES notation for 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol?
The canonical SMILES for 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol is CCOc1cc(C)nc(C(CN)CO)n1.
What is the InChIKey of 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol?
The InChIKey is RCSUWCDMWBQPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-15-9-4-7(2)12-10(13-9)8(5-11)6-14/h4,8,14H,3,5-6,11H2,1-2H3.
What are the key properties of 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol?
3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol has a molecular weight of 211.26 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-(4-ethoxy-6-methylpyrimidin-2-yl)propan-1-ol is sourced from PubChem (CID 112635479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).