(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol

C11H18N2O — CID 103971270

IUPAC(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol
SMILESC/C(=C/C(C)O)c1c(C)nn(C)c1C
InChIInChI=1S/C11H18N2O/c1-7(6-8(2)14)11-9(3)12-13(5)10(11)4/h6,8,14H,1-5H3/b7-6-
InChIKeyJSKLULPPMUQHMI-SREVYHEPSA-N
MW194.28 g/mol
LogP1.82
Rot. Bonds2

About (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol

(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol (PubChem CID 103971270) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol.

Molecular Properties

Compound Name(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol
PubChem CID103971270
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol
SMILESC/C(=C/C(C)O)c1c(C)nn(C)c1C
InChIInChI=1S/C11H18N2O/c1-7(6-8(2)14)11-9(3)12-13(5)10(11)4/h6,8,14H,1-5H3/b7-6-
InChIKeyJSKLULPPMUQHMI-SREVYHEPSA-N
XLogP1.82
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-one
CID 103970874
(E)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-enoic acid
CID 112721875
4-[(1E)-1-fluorobuta-1,3-dienyl]-1,3,5-trimethylpyrazole
CID 143740724
ethyl 5-(1,3,5-trimethylpyrazol-4-yl)hexa-2,4-dienoate
CID 114193780
3-methyl-1-(1,3,5-trimethylpyrazol-4-yl)pentan-1-one
CID 105091756
N-hydroxy-1,3,5-trimethylpyrazole-4-carboxamide
CID 28742914
N-but-3-yn-2-yl-1,3,5-trimethylpyrazole-4-carboxamide
CID 114389977
N-(2-amino-3-hydroxybutyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 64541906
2-(1-propan-2-ylpyrazol-3-yl)-1-(1,3,5-trimethylpyrazol-4-yl)ethanol
CID 105103448
N-(2-bromopropyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 114308682
[2-(2-hydroxypropyl)pyrrolidin-1-yl]-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 79547043
1-[3-(2-hydroxypropyl)-1,5-dimethylpyrazol-4-yl]ethanone
CID 22966457

Frequently Asked Questions

What is the IUPAC name of (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol?
The IUPAC name of (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol (CID 103971270) is (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol.
What is the SMILES notation for (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol?
The canonical SMILES for (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol is C/C(=C/C(C)O)c1c(C)nn(C)c1C.
What is the InChIKey of (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol?
The InChIKey is JSKLULPPMUQHMI-SREVYHEPSA-N. The full InChI is InChI=1S/C11H18N2O/c1-7(6-8(2)14)11-9(3)12-13(5)10(11)4/h6,8,14H,1-5H3/b7-6-.
What are the key properties of (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol?
(Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol has a molecular weight of 194.28 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(1,3,5-trimethylpyrazol-4-yl)pent-3-en-2-ol is sourced from PubChem (CID 103971270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).