N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide

C14H22N4O2 — CID 103219501

IUPACN-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
SMILESCCN(C(=O)Cn1ncc(NC(C)C)cc1=O)C1CC1
InChIInChI=1S/C14H22N4O2/c1-4-17(12-5-6-12)14(20)9-18-13(19)7-11(8-15-18)16-10(2)3/h7-8,10,12,16H,4-6,9H2,1-3H3
InChIKeyOZWQCAXMRRFNNN-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.07
Rot. Bonds6

About N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide

N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide (PubChem CID 103219501) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
PubChem CID103219501
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
SMILESCCN(C(=O)Cn1ncc(NC(C)C)cc1=O)C1CC1
InChIInChI=1S/C14H22N4O2/c1-4-17(12-5-6-12)14(20)9-18-13(19)7-11(8-15-18)16-10(2)3/h7-8,10,12,16H,4-6,9H2,1-3H3
InChIKeyOZWQCAXMRRFNNN-UHFFFAOYSA-N
XLogP1.07
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide (CID 103219501) is N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide is CCN(C(=O)Cn1ncc(NC(C)C)cc1=O)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The InChIKey is OZWQCAXMRRFNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-4-17(12-5-6-12)14(20)9-18-13(19)7-11(8-15-18)16-10(2)3/h7-8,10,12,16H,4-6,9H2,1-3H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide has a molecular weight of 278.36 g/mol, XLogP of 1.07, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide is sourced from PubChem (CID 103219501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).