(1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine

C13H21N3O — CID 114268609

IUPAC(1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine
SMILESCOc1ccc(CN[C@H](C)C2CCCC2)nn1
InChIInChI=1S/C13H21N3O/c1-10(11-5-3-4-6-11)14-9-12-7-8-13(17-2)16-15-12/h7-8,10-11,14H,3-6,9H2,1-2H3/t10-/m1/s1
InChIKeyYNZOMHKJYIQYPI-SNVBAGLBSA-N
MW235.33 g/mol
LogP2.15
Rot. Bonds5

About (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine

(1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine (PubChem CID 114268609) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine
PubChem CID114268609
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name(1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine
SMILESCOc1ccc(CN[C@H](C)C2CCCC2)nn1
InChIInChI=1S/C13H21N3O/c1-10(11-5-3-4-6-11)14-9-12-7-8-13(17-2)16-15-12/h7-8,10-11,14H,3-6,9H2,1-2H3/t10-/m1/s1
InChIKeyYNZOMHKJYIQYPI-SNVBAGLBSA-N
XLogP2.15
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclopentyl-N-[(3,4-dimethoxyphenyl)methyl]ethanamine
CID 62633318
N-[(6-methoxypyridazin-3-yl)methyl]-1-phenylethanamine
CID 114268555
(1R)-1-cyclopentyl-N-(quinolin-2-ylmethyl)ethanamine
CID 81395320
(1R)-1-cyclohexyl-N-[(2-methoxy-3-pyridinyl)methyl]ethanamine
CID 81384352
(1R)-N-[(6-methoxypyridazin-3-yl)methyl]-1-pyrimidin-2-ylethanamine
CID 156830398
2-N-[(6-methoxypyridazin-3-yl)methyl]-1-N,1-N,3-trimethylbutane-1,2-diamine
CID 114268584
(1S)-1-cycloheptyl-N-(pyridin-2-ylmethyl)ethanamine
CID 81391298
(1S)-1-cyclopentyl-N-[(3,5-dimethoxyphenyl)methyl]ethanamine
CID 81385952
(1R)-1-cyclopentyl-N-[(3,5-dimethoxyphenyl)methyl]ethanamine
CID 81395158
(1R)-N-[(1-tert-butyltriazol-4-yl)methyl]-1-cycloheptylethanamine
CID 103399276
N-[cycloheptyl-(6-methoxypyridazin-3-yl)methyl]ethanamine
CID 103374557
(1S)-1-cyclohexyl-N-[(3,4-dimethoxy-2-pyridinyl)methyl]ethanamine
CID 103172633

Frequently Asked Questions

What is the IUPAC name of (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine?
The IUPAC name of (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine (CID 114268609) is (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine.
What is the SMILES notation for (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine?
The canonical SMILES for (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine is COc1ccc(CN[C@H](C)C2CCCC2)nn1.
What is the InChIKey of (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine?
The InChIKey is YNZOMHKJYIQYPI-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H21N3O/c1-10(11-5-3-4-6-11)14-9-12-7-8-13(17-2)16-15-12/h7-8,10-11,14H,3-6,9H2,1-2H3/t10-/m1/s1.
What are the key properties of (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine?
(1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine has a molecular weight of 235.33 g/mol, XLogP of 2.15, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-cyclopentyl-N-[(6-methoxypyridazin-3-yl)methyl]ethanamine is sourced from PubChem (CID 114268609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).