N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

C10H15N3O3 — CID 55171979

IUPACN-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESO=C1CCC(C(=O)NCC(O)C2CC2)=NN1
InChIInChI=1S/C10H15N3O3/c14-8(6-1-2-6)5-11-10(16)7-3-4-9(15)13-12-7/h6,8,14H,1-5H2,(H,11,16)(H,13,15)
InChIKeyDLZILOKGUWVVPX-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.86
Rot. Bonds4

About N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide

N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide (PubChem CID 55171979) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
PubChem CID55171979
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC NameN-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide
SMILESO=C1CCC(C(=O)NCC(O)C2CC2)=NN1
InChIInChI=1S/C10H15N3O3/c14-8(6-1-2-6)5-11-10(16)7-3-4-9(15)13-12-7/h6,8,14H,1-5H2,(H,11,16)(H,13,15)
InChIKeyDLZILOKGUWVVPX-UHFFFAOYSA-N
XLogP-0.86
TPSA90.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The IUPAC name of N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide (CID 55171979) is N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is O=C1CCC(C(=O)NCC(O)C2CC2)=NN1.
What is the InChIKey of N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
The InChIKey is DLZILOKGUWVVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c14-8(6-1-2-6)5-11-10(16)7-3-4-9(15)13-12-7/h6,8,14H,1-5H2,(H,11,16)(H,13,15).
What are the key properties of N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide?
N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide has a molecular weight of 225.25 g/mol, XLogP of -0.86, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyl-2-hydroxyethyl)-6-oxo-4,5-dihydro-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 55171979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).