1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one

C15H25N5O — CID 71807487

IUPAC1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one
SMILESCCCCC(=O)N1CCN(c2cc(N(C)C)cnn2)CC1
InChIInChI=1S/C15H25N5O/c1-4-5-6-15(21)20-9-7-19(8-10-20)14-11-13(18(2)3)12-16-17-14/h11-12H,4-10H2,1-3H3
InChIKeyYUYSOVGJWNFKDW-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.38
Rot. Bonds5

About 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one

1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one (PubChem CID 71807487) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one.

Molecular Properties

Compound Name1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one
PubChem CID71807487
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one
SMILESCCCCC(=O)N1CCN(c2cc(N(C)C)cnn2)CC1
InChIInChI=1S/C15H25N5O/c1-4-5-6-15(21)20-9-7-19(8-10-20)14-11-13(18(2)3)12-16-17-14/h11-12H,4-10H2,1-3H3
InChIKeyYUYSOVGJWNFKDW-UHFFFAOYSA-N
XLogP1.38
TPSA52.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one?
The IUPAC name of 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one (CID 71807487) is 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one.
What is the SMILES notation for 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one?
The canonical SMILES for 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one is CCCCC(=O)N1CCN(c2cc(N(C)C)cnn2)CC1.
What is the InChIKey of 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one?
The InChIKey is YUYSOVGJWNFKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-4-5-6-15(21)20-9-7-19(8-10-20)14-11-13(18(2)3)12-16-17-14/h11-12H,4-10H2,1-3H3.
What are the key properties of 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one?
1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one has a molecular weight of 291.40 g/mol, XLogP of 1.38, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[5-(dimethylamino)pyridazin-3-yl]piperazin-1-yl]pentan-1-one is sourced from PubChem (CID 71807487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).