2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide

C19H22FN5O — CID 122279645

IUPAC2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
SMILESO=C(CN1CCN(c2ccc(C3CC3)nn2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C19H22FN5O/c20-15-2-1-3-16(12-15)21-19(26)13-24-8-10-25(11-9-24)18-7-6-17(22-23-18)14-4-5-14/h1-3,6-7,12,14H,4-5,8-11,13H2,(H,21,26)
InChIKeyVUQOZQYOIIDVHX-UHFFFAOYSA-N
MW355.42 g/mol
LogP2.25
Rot. Bonds5

About 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide

2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide (PubChem CID 122279645) has the molecular formula C19H22FN5O and a molecular weight of 355.42 g/mol. Its IUPAC name is 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
PubChem CID122279645
Molecular FormulaC19H22FN5O
Molecular Weight355.42 g/mol
Exact Mass355.18
IUPAC Name2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
SMILESO=C(CN1CCN(c2ccc(C3CC3)nn2)CC1)Nc1cccc(F)c1
InChIInChI=1S/C19H22FN5O/c20-15-2-1-3-16(12-15)21-19(26)13-24-8-10-25(11-9-24)18-7-6-17(22-23-18)14-4-5-14/h1-3,6-7,12,14H,4-5,8-11,13H2,(H,21,26)
InChIKeyVUQOZQYOIIDVHX-UHFFFAOYSA-N
XLogP2.25
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.42
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-(3-fluorophenyl)acetamide
CID 122278424
2-[4-(2-cyclopentylacetyl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide
CID 9020123
2-[4-[2-(3-fluoroanilino)-2-oxoethyl]piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 8711203
N-(3-fluorophenyl)-2-(4-prop-2-enylpiperazin-1-yl)acetamide
CID 8711083
N-(3-fluorophenyl)-2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetamide
CID 9338225
1-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenylpiperidine-4-carboxamide
CID 9134379
N-(3-fluorophenyl)-2-[4-[2-(4-methylpiperidin-1-yl)acetyl]piperazin-1-yl]acetamide
CID 8558075
4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide
CID 122279690
N-(3-fluorophenyl)-2-[4-(3-methylbut-2-enyl)piperazin-1-yl]acetamide
CID 8690682
4-[2-(3-fluoroanilino)-2-oxoethyl]-N-phenylpiperazine-1-carboxamide
CID 17397265
ethyl 4-[2-(3-fluoroanilino)-2-oxoethyl]piperazine-1-carboxylate
CID 2654273
N-(3-fluorophenyl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide
CID 27855792

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide (CID 122279645) is 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide is O=C(CN1CCN(c2ccc(C3CC3)nn2)CC1)Nc1cccc(F)c1.
What is the InChIKey of 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide?
The InChIKey is VUQOZQYOIIDVHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN5O/c20-15-2-1-3-16(12-15)21-19(26)13-24-8-10-25(11-9-24)18-7-6-17(22-23-18)14-4-5-14/h1-3,6-7,12,14H,4-5,8-11,13H2,(H,21,26).
What are the key properties of 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide?
2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide has a molecular weight of 355.42 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 122279645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).