N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide

C17H30N6O3 — CID 90292314

IUPACN-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide
SMILESCC(C)NCCN(CC(=O)NC(C)C)C(=O)CCNc1ccc(=O)[nH]n1
InChIInChI=1S/C17H30N6O3/c1-12(2)18-9-10-23(11-16(25)20-13(3)4)17(26)7-8-19-14-5-6-15(24)22-21-14/h5-6,12-13,18H,7-11H2,1-4H3,(H,19,21)(H,20,25)(H,22,24)
InChIKeyHYTZWTJBYIKOIL-UHFFFAOYSA-N
MW366.47 g/mol
LogP-0.08
Rot. Bonds11

About N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide

N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide (PubChem CID 90292314) has the molecular formula C17H30N6O3 and a molecular weight of 366.47 g/mol. Its IUPAC name is N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide
PubChem CID90292314
Molecular FormulaC17H30N6O3
Molecular Weight366.47 g/mol
Exact Mass366.24
IUPAC NameN-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide
SMILESCC(C)NCCN(CC(=O)NC(C)C)C(=O)CCNc1ccc(=O)[nH]n1
InChIInChI=1S/C17H30N6O3/c1-12(2)18-9-10-23(11-16(25)20-13(3)4)17(26)7-8-19-14-5-6-15(24)22-21-14/h5-6,12-13,18H,7-11H2,1-4H3,(H,19,21)(H,20,25)(H,22,24)
InChIKeyHYTZWTJBYIKOIL-UHFFFAOYSA-N
XLogP-0.08
TPSA119.22 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 5-0.08
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide?
The IUPAC name of N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide (CID 90292314) is N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide.
What is the SMILES notation for N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide?
The canonical SMILES for N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide is CC(C)NCCN(CC(=O)NC(C)C)C(=O)CCNc1ccc(=O)[nH]n1.
What is the InChIKey of N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide?
The InChIKey is HYTZWTJBYIKOIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N6O3/c1-12(2)18-9-10-23(11-16(25)20-13(3)4)17(26)7-8-19-14-5-6-15(24)22-21-14/h5-6,12-13,18H,7-11H2,1-4H3,(H,19,21)(H,20,25)(H,22,24).
What are the key properties of N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide?
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide has a molecular weight of 366.47 g/mol, XLogP of -0.08, 11 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-[(6-oxo-1H-pyridazin-3-yl)amino]-N-[2-(propan-2-ylamino)ethyl]propanamide is sourced from PubChem (CID 90292314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).