N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine

C14H21N5O — CID 13382928

IUPACN-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine
SMILESC(=N/Nc1ccc(N2CCOCC2)nn1)\C1CCCC1
InChIInChI=1S/C14H21N5O/c1-2-4-12(3-1)11-15-16-13-5-6-14(18-17-13)19-7-9-20-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,16,17)/b15-11+
InChIKeyKJTWLHJSFFNNGS-RVDMUPIBSA-N
MW275.36 g/mol
LogP1.90
Rot. Bonds4

About N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine

N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine (PubChem CID 13382928) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine.

Molecular Properties

Compound NameN-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine
PubChem CID13382928
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine
SMILESC(=N/Nc1ccc(N2CCOCC2)nn1)\C1CCCC1
InChIInChI=1S/C14H21N5O/c1-2-4-12(3-1)11-15-16-13-5-6-14(18-17-13)19-7-9-20-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,16,17)/b15-11+
InChIKeyKJTWLHJSFFNNGS-RVDMUPIBSA-N
XLogP1.90
TPSA62.64 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Morpholine, 4-(6-hydrazino-5-methyl-2-pyridazinyl)-, dihydrochloride, hydrate
CID 216109
Cyclohexanone, 2-(6-morpholino-3-pyridazinyl)hydrazone
CID 3053197
3-Amino-6-morpholinopyridazine
CID 13114295
3(2H)-Pyridazinone, 6-(4-morpholinyl)-, cyclopentylidenehydrazone
CID 13382884
3(2H)-Pyridazinone, 6-(4-morpholinyl)-, (1-methyl-2-(4-morpholinyl)ethylidene)hydrazone
CID 13382926
2-[6-(4-Morpholinyl)-3-pyridazinyl]hydrazinecarbothioamide
CID 2838721
N-methyl-6-morpholinopyridazin-3-amine
CID 12320368
3-Hydrazino-6-morpholino-pyridazine
CID 12603548
4-(6-Hydrazineylidene-1,6-dihydropyridazin-3-yl)morpholine dihydrochloride
CID 12603549
6-morpholin-4-yl-N-(propan-2-ylideneamino)pyridazin-3-amine
CID 12713259
1-Methyl-1-(6-morpholin-4-ylpyridazin-3-yl)hydrazine
CID 13016471
6-(2,6-Dimethyl-morpholino)-3-hydrazino-pyridazine dihydrochloride
CID 20294663

Frequently Asked Questions

What is the IUPAC name of N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine?
The IUPAC name of N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine (CID 13382928) is N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine.
What is the SMILES notation for N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine?
The canonical SMILES for N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine is C(=N/Nc1ccc(N2CCOCC2)nn1)\C1CCCC1.
What is the InChIKey of N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine?
The InChIKey is KJTWLHJSFFNNGS-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H21N5O/c1-2-4-12(3-1)11-15-16-13-5-6-14(18-17-13)19-7-9-20-10-8-19/h5-6,11-12H,1-4,7-10H2,(H,16,17)/b15-11+.
What are the key properties of N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine?
N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine has a molecular weight of 275.36 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-cyclopentylmethylideneamino]-6-morpholin-4-ylpyridazin-3-amine is sourced from PubChem (CID 13382928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).