2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol

C10H17N3O — CID 6459535

IUPAC2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol
SMILESCCCc1nc(C)cc(NCCO)n1
InChIInChI=1S/C10H17N3O/c1-3-4-9-12-8(2)7-10(13-9)11-5-6-14/h7,14H,3-6H2,1-2H3,(H,11,12,13)
InChIKeyABIPLWRKMDPWKQ-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.14
Rot. Bonds5

About 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol

2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol (PubChem CID 6459535) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol
PubChem CID6459535
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol
SMILESCCCc1nc(C)cc(NCCO)n1
InChIInChI=1S/C10H17N3O/c1-3-4-9-12-8(2)7-10(13-9)11-5-6-14/h7,14H,3-6H2,1-2H3,(H,11,12,13)
InChIKeyABIPLWRKMDPWKQ-UHFFFAOYSA-N
XLogP1.14
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol (CID 6459535) is 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol is CCCc1nc(C)cc(NCCO)n1.
What is the InChIKey of 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol?
The InChIKey is ABIPLWRKMDPWKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-3-4-9-12-8(2)7-10(13-9)11-5-6-14/h7,14H,3-6H2,1-2H3,(H,11,12,13).
What are the key properties of 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol?
2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol has a molecular weight of 195.27 g/mol, XLogP of 1.14, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-methyl-2-propylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 6459535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).