5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole

C9H12N2 — CID 155741579

IUPAC5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole
SMILESC=C(C)c1cn[nH]c1/C=C\C
InChIInChI=1S/C9H12N2/c1-4-5-9-8(7(2)3)6-10-11-9/h4-6H,2H2,1,3H3,(H,10,11)/b5-4-
InChIKeyVVVWLWBOOHXAKN-PLNGDYQASA-N
MW148.21 g/mol
LogP2.48
Rot. Bonds2

About 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole

5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole (PubChem CID 155741579) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole.

Molecular Properties

Compound Name5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole
PubChem CID155741579
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole
SMILESC=C(C)c1cn[nH]c1/C=C\C
InChIInChI=1S/C9H12N2/c1-4-5-9-8(7(2)3)6-10-11-9/h4-6H,2H2,1,3H3,(H,10,11)/b5-4-
InChIKeyVVVWLWBOOHXAKN-PLNGDYQASA-N
XLogP2.48
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole?
The IUPAC name of 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole (CID 155741579) is 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole.
What is the SMILES notation for 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole?
The canonical SMILES for 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole is C=C(C)c1cn[nH]c1/C=C\C.
What is the InChIKey of 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole?
The InChIKey is VVVWLWBOOHXAKN-PLNGDYQASA-N. The full InChI is InChI=1S/C9H12N2/c1-4-5-9-8(7(2)3)6-10-11-9/h4-6H,2H2,1,3H3,(H,10,11)/b5-4-.
What are the key properties of 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole?
5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole has a molecular weight of 148.21 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-prop-1-enyl]-4-prop-1-en-2-yl-1H-pyrazole is sourced from PubChem (CID 155741579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).