[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol

C13H24N4O2 — CID 102931918

IUPAC[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol
SMILESCCCc1nn(C)c(N2CC(C)OC(CO)C2)c1N
InChIInChI=1S/C13H24N4O2/c1-4-5-11-12(14)13(16(3)15-11)17-6-9(2)19-10(7-17)8-18/h9-10,18H,4-8,14H2,1-3H3
InChIKeyFJQWOYKFCPIVLF-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.54
Rot. Bonds4

About [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol

[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol (PubChem CID 102931918) has the molecular formula C13H24N4O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol
PubChem CID102931918
Molecular FormulaC13H24N4O2
Molecular Weight268.36 g/mol
Exact Mass268.19
IUPAC Name[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol
SMILESCCCc1nn(C)c(N2CC(C)OC(CO)C2)c1N
InChIInChI=1S/C13H24N4O2/c1-4-5-11-12(14)13(16(3)15-11)17-6-9(2)19-10(7-17)8-18/h9-10,18H,4-8,14H2,1-3H3
InChIKeyFJQWOYKFCPIVLF-UHFFFAOYSA-N
XLogP0.54
TPSA76.54 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol (CID 102931918) is [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol is CCCc1nn(C)c(N2CC(C)OC(CO)C2)c1N.
What is the InChIKey of [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol?
The InChIKey is FJQWOYKFCPIVLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O2/c1-4-5-11-12(14)13(16(3)15-11)17-6-9(2)19-10(7-17)8-18/h9-10,18H,4-8,14H2,1-3H3.
What are the key properties of [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol?
[4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol has a molecular weight of 268.36 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-amino-1-methyl-3-propylpyrazol-5-yl)-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102931918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).