6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide

C11H14ClN3O2 — CID 106120095

IUPAC6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide
SMILESO=C(NCC1CCC(O)C1)c1ccc(Cl)nn1
InChIInChI=1S/C11H14ClN3O2/c12-10-4-3-9(14-15-10)11(17)13-6-7-1-2-8(16)5-7/h3-4,7-8,16H,1-2,5-6H2,(H,13,17)
InChIKeyARQHWRSBIQFCMH-UHFFFAOYSA-N
MW255.70 g/mol
LogP1.02
Rot. Bonds3

About 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide

6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide (PubChem CID 106120095) has the molecular formula C11H14ClN3O2 and a molecular weight of 255.70 g/mol. Its IUPAC name is 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide
PubChem CID106120095
Molecular FormulaC11H14ClN3O2
Molecular Weight255.70 g/mol
Exact Mass255.08
IUPAC Name6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide
SMILESO=C(NCC1CCC(O)C1)c1ccc(Cl)nn1
InChIInChI=1S/C11H14ClN3O2/c12-10-4-3-9(14-15-10)11(17)13-6-7-1-2-8(16)5-7/h3-4,7-8,16H,1-2,5-6H2,(H,13,17)
InChIKeyARQHWRSBIQFCMH-UHFFFAOYSA-N
XLogP1.02
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-[(3-hydroxycyclohexyl)methyl]pyridazine-3-carboxamide
CID 114146199
6-chloro-N-[(4-hydroxycyclohexyl)methyl]pyridazine-3-carboxamide
CID 114146608
6-chloro-N-(oxan-4-ylmethyl)pyridazine-3-carboxamide
CID 63712476
6-chloro-N-(oxolan-3-ylmethyl)pyridazine-3-carboxamide
CID 61052267
6-chloro-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridazine-3-carboxamide
CID 61216005
6-chloro-N-(2-cyclobutylethyl)pyridazine-3-carboxamide
CID 86026045
6-bromo-N-[(3-hydroxycyclopentyl)methyl]pyridine-2-carboxamide
CID 103279976
6-chloro-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyridazine-3-carboxamide
CID 79357896
6-chloro-N-(2-cyclohexylethyl)pyridazine-3-carboxamide
CID 54932474
4-(carbamoylamino)-N-[(3-hydroxycyclopentyl)methyl]benzamide
CID 103279882
N-[(3-hydroxycyclopentyl)methyl]quinoxaline-2-carboxamide
CID 103280180
6-chloro-N-[(4-methylmorpholin-2-yl)methyl]pyridazine-3-carboxamide
CID 79083051

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide (CID 106120095) is 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide is O=C(NCC1CCC(O)C1)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide?
The InChIKey is ARQHWRSBIQFCMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O2/c12-10-4-3-9(14-15-10)11(17)13-6-7-1-2-8(16)5-7/h3-4,7-8,16H,1-2,5-6H2,(H,13,17).
What are the key properties of 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide?
6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide has a molecular weight of 255.70 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(3-hydroxycyclopentyl)methyl]pyridazine-3-carboxamide is sourced from PubChem (CID 106120095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).