4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide

C18H21N5O — CID 122279690

IUPAC4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCN(c2ccc(C3CC3)nn2)CC1
InChIInChI=1S/C18H21N5O/c24-18(19-15-4-2-1-3-5-15)23-12-10-22(11-13-23)17-9-8-16(20-21-17)14-6-7-14/h1-5,8-9,14H,6-7,10-13H2,(H,19,24)
InChIKeyTWWGROZCIJYUDG-UHFFFAOYSA-N
MW323.40 g/mol
LogP2.71
Rot. Bonds3

About 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide

4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide (PubChem CID 122279690) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide
PubChem CID122279690
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCN(c2ccc(C3CC3)nn2)CC1
InChIInChI=1S/C18H21N5O/c24-18(19-15-4-2-1-3-5-15)23-12-10-22(11-13-23)17-9-8-16(20-21-17)14-6-7-14/h1-5,8-9,14H,6-7,10-13H2,(H,19,24)
InChIKeyTWWGROZCIJYUDG-UHFFFAOYSA-N
XLogP2.71
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(6-cyclopropylpyridazin-3-yl)-N-thiophen-2-ylpiperazine-1-carboxamide
CID 122160627
[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-phenylmethanone
CID 122279226
cyclopropyl-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]methanone
CID 122279215
4-(5-methyl-2-pyridinyl)-N-phenylpiperazine-1-carboxamide
CID 59676624
[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-(2-iodophenyl)methanone
CID 122279263
4-[6-[(5-methyl-2-pyridinyl)amino]pyridazin-3-yl]-N-phenylpiperazine-1-carboxamide
CID 56919619
N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
CID 735809
N-(4-cyclopropylphenyl)-4-[6-(trifluoromethyl)pyridazin-3-yl]piperazine-1-carboxamide
CID 155701537
1-[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-2-phenoxypropan-1-one
CID 122279328
[4-(6-cyclopropylpyridazin-3-yl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 122279219
4-(5-cyano-2-pyridinyl)-N-phenylpiperazine-1-carboxamide
CID 2746537
N-(4-chlorophenyl)-4-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]piperazine-1-carboxamide
CID 122336002

Frequently Asked Questions

What is the IUPAC name of 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide?
The IUPAC name of 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide (CID 122279690) is 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide?
The canonical SMILES for 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide is O=C(Nc1ccccc1)N1CCN(c2ccc(C3CC3)nn2)CC1.
What is the InChIKey of 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide?
The InChIKey is TWWGROZCIJYUDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O/c24-18(19-15-4-2-1-3-5-15)23-12-10-22(11-13-23)17-9-8-16(20-21-17)14-6-7-14/h1-5,8-9,14H,6-7,10-13H2,(H,19,24).
What are the key properties of 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide?
4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide has a molecular weight of 323.40 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide is sourced from PubChem (CID 122279690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).