(1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol

C11H16N4O — CID 63976465

IUPAC(1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol
SMILESCCCn1ccnc1C(O)c1cnn(C)c1
InChIInChI=1S/C11H16N4O/c1-3-5-15-6-4-12-11(15)10(16)9-7-13-14(2)8-9/h4,6-8,10,16H,3,5H2,1-2H3
InChIKeyYERCUSBLIWNSBA-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.11
Rot. Bonds4

About (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol

(1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol (PubChem CID 63976465) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol.

Molecular Properties

Compound Name(1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol
PubChem CID63976465
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name(1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol
SMILESCCCn1ccnc1C(O)c1cnn(C)c1
InChIInChI=1S/C11H16N4O/c1-3-5-15-6-4-12-11(15)10(16)9-7-13-14(2)8-9/h4,6-8,10,16H,3,5H2,1-2H3
InChIKeyYERCUSBLIWNSBA-UHFFFAOYSA-N
XLogP1.11
TPSA55.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol?
The IUPAC name of (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol (CID 63976465) is (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol.
What is the SMILES notation for (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol?
The canonical SMILES for (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol is CCCn1ccnc1C(O)c1cnn(C)c1.
What is the InChIKey of (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol?
The InChIKey is YERCUSBLIWNSBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-3-5-15-6-4-12-11(15)10(16)9-7-13-14(2)8-9/h4,6-8,10,16H,3,5H2,1-2H3.
What are the key properties of (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol?
(1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol has a molecular weight of 220.28 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpyrazol-4-yl)-(1-propylimidazol-2-yl)methanol is sourced from PubChem (CID 63976465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).