N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide

C15H23N3O3 — CID 115759703

IUPACN-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)N(C)CC2(O)CCCC2)ccc1=O
InChIInChI=1S/C15H23N3O3/c1-3-10-18-13(19)7-6-12(16-18)14(20)17(2)11-15(21)8-4-5-9-15/h6-7,21H,3-5,8-11H2,1-2H3
InChIKeyKKSCLOFZKSPEJH-UHFFFAOYSA-N
MW293.37 g/mol
LogP1.03
Rot. Bonds5

About N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide

N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide (PubChem CID 115759703) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide
PubChem CID115759703
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)N(C)CC2(O)CCCC2)ccc1=O
InChIInChI=1S/C15H23N3O3/c1-3-10-18-13(19)7-6-12(16-18)14(20)17(2)11-15(21)8-4-5-9-15/h6-7,21H,3-5,8-11H2,1-2H3
InChIKeyKKSCLOFZKSPEJH-UHFFFAOYSA-N
XLogP1.03
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-hydroxycyclopentyl)methyl]-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 49754476
6-[2-(1-Hydroxycyclopentyl)ethynyl]-2-propan-2-ylpyridazin-3-one
CID 142202626
N-[(1-hydroxycyclopentyl)methyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 49754465
N-[1-(hydroxymethyl)cyclopentyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 55082531
N-[1-(hydroxymethyl)cyclopentyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 62517563
1-butyl-N-[1-(hydroxymethyl)cyclopentyl]-6-oxopyridazine-3-carboxamide
CID 62519118
1-butyl-N-[(1-hydroxycyclopentyl)methyl]-6-oxopyridazine-3-carboxamide
CID 64176693
N-[(1-hydroxycyclopentyl)methyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 64176702
N-[(1-hydroxycyclopentyl)methyl]-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 64178422
N-[(1-hydroxycyclohexyl)methyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 64866558
N-(2-ethyl-2-hydroxybutyl)-6-oxo-1-propylpyridazine-3-carboxamide
CID 65111972
N-(2-ethyl-2-hydroxybutyl)-1-methyl-6-oxopyridazine-3-carboxamide
CID 65112053

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide (CID 115759703) is N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide is CCCn1nc(C(=O)N(C)CC2(O)CCCC2)ccc1=O.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide?
The InChIKey is KKSCLOFZKSPEJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-3-10-18-13(19)7-6-12(16-18)14(20)17(2)11-15(21)8-4-5-9-15/h6-7,21H,3-5,8-11H2,1-2H3.
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide?
N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-N-methyl-6-oxo-1-propylpyridazine-3-carboxamide is sourced from PubChem (CID 115759703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).