N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide

C11H17N3O3 — CID 54916808

IUPACN-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide
SMILESCC(C)N(CCCO)C(=O)c1ccc(=O)[nH]n1
InChIInChI=1S/C11H17N3O3/c1-8(2)14(6-3-7-15)11(17)9-4-5-10(16)13-12-9/h4-5,8,15H,3,6-7H2,1-2H3,(H,13,16)
InChIKeyYXMGZMIGMYQSRI-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.00
Rot. Bonds5

About N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide

N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide (PubChem CID 54916808) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide
PubChem CID54916808
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC NameN-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide
SMILESCC(C)N(CCCO)C(=O)c1ccc(=O)[nH]n1
InChIInChI=1S/C11H17N3O3/c1-8(2)14(6-3-7-15)11(17)9-4-5-10(16)13-12-9/h4-5,8,15H,3,6-7H2,1-2H3,(H,13,16)
InChIKeyYXMGZMIGMYQSRI-UHFFFAOYSA-N
XLogP0.00
TPSA86.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-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

6-oxo-N-pentyl-N-propan-2-yl-1H-pyridazine-3-carboxamide
CID 103616206
2-[(6-oxo-1H-pyridazine-3-carbonyl)-propan-2-ylamino]acetic acid
CID 60832051
6-hydrazinyl-N-(3-hydroxypropyl)-N-propan-2-ylpyridazine-3-carboxamide
CID 62243163
N-(3-hydroxypropyl)-N-propan-2-yl-2H-benzotriazole-5-carboxamide
CID 54916380
4-carbamothioyl-N-(3-hydroxypropyl)-N-propan-2-ylbenzamide
CID 54999256
N-[(2S)-2-(diethylamino)-3-methylbutyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 38593214
N-(2-hydroxyethyl)-6-oxo-N-(2,2,2-trifluoroethyl)-1H-pyridazine-3-carboxamide
CID 113339822
N-(3-hydroxypropyl)-4-iodo-N-propan-2-ylbenzamide
CID 61040122
6-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1H-pyridazine-3-carboxamide
CID 30539711
N-[(2R)-2-(dimethylamino)-3-methylbutyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 94182994
N-[2-(diethylamino)-4-methylpentyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 86984951
N-(3-amino-2-methylpropyl)-N-ethyl-6-oxo-1H-pyridazine-3-carboxamide
CID 114040760

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide?
The IUPAC name of N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide (CID 54916808) is N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide is CC(C)N(CCCO)C(=O)c1ccc(=O)[nH]n1.
What is the InChIKey of N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide?
The InChIKey is YXMGZMIGMYQSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-8(2)14(6-3-7-15)11(17)9-4-5-10(16)13-12-9/h4-5,8,15H,3,6-7H2,1-2H3,(H,13,16).
What are the key properties of N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide?
N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide has a molecular weight of 239.27 g/mol, XLogP of 0.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxypropyl)-6-oxo-N-propan-2-yl-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 54916808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).