N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine

C16H24N4O — CID 71928443

IUPACN-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine
SMILESCN(CC1CN(C2C=CCCC2)CCO1)c1cccnn1
InChIInChI=1S/C16H24N4O/c1-19(16-8-5-9-17-18-16)12-15-13-20(10-11-21-15)14-6-3-2-4-7-14/h3,5-6,8-9,14-15H,2,4,7,10-13H2,1H3
InChIKeyYBXCOJCGCIFSEL-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.72
Rot. Bonds4

About N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine

N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine (PubChem CID 71928443) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine.

Molecular Properties

Compound NameN-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine
PubChem CID71928443
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine
SMILESCN(CC1CN(C2C=CCCC2)CCO1)c1cccnn1
InChIInChI=1S/C16H24N4O/c1-19(16-8-5-9-17-18-16)12-15-13-20(10-11-21-15)14-6-3-2-4-7-14/h3,5-6,8-9,14-15H,2,4,7,10-13H2,1H3
InChIKeyYBXCOJCGCIFSEL-UHFFFAOYSA-N
XLogP1.72
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[[4-[(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 71872633
2-[[(2S)-4-[(1S)-cyclohex-2-en-1-yl]morpholin-2-yl]methyl-methylamino]acetamide
CID 124875437
2-[2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]acetamide
CID 71872661
N-[[(2S)-4-[(2-fluorophenyl)methyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 96998292
N-methyl-N-[[(2R)-4-[(5-methyl-1,2-oxazol-3-yl)methyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 97004851
3-[(2S)-2-[[methyl(pyridazin-3-yl)amino]methyl]morpholin-4-yl]-1-piperidin-1-ylpropan-1-one
CID 96998264
N-[[(2S)-4-[(1R)-1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]morpholin-2-yl]methyl]-N-methylpyridazin-3-amine
CID 97021534
N-methyl-N-[[(2S)-4-[2-(1,2,4-triazol-1-yl)ethyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 96998278
N-[[4-(cyclobutylmethyl)morpholin-2-yl]methyl]-N-ethylpyridazin-3-amine
CID 71928433
N-methyl-N-[[4-[3-(4-methyl-3-pyridinyl)propyl]morpholin-2-yl]methyl]pyridazin-3-amine
CID 167853689
[2-formyl-4-[2-[[methyl(pyridazin-3-yl)amino]methyl]morpholine-4-carbonyl]phenyl]boronic acid
CID 167923281
methyl 2-[(2R)-4-[(1R)-cyclohex-2-en-1-yl]morpholin-2-yl]acetate
CID 96999144

Frequently Asked Questions

What is the IUPAC name of N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine?
The IUPAC name of N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine (CID 71928443) is N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine.
What is the SMILES notation for N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine?
The canonical SMILES for N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine is CN(CC1CN(C2C=CCCC2)CCO1)c1cccnn1.
What is the InChIKey of N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine?
The InChIKey is YBXCOJCGCIFSEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-19(16-8-5-9-17-18-16)12-15-13-20(10-11-21-15)14-6-3-2-4-7-14/h3,5-6,8-9,14-15H,2,4,7,10-13H2,1H3.
What are the key properties of N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine?
N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine has a molecular weight of 288.39 g/mol, XLogP of 1.72, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-cyclohex-2-en-1-ylmorpholin-2-yl)methyl]-N-methylpyridazin-3-amine is sourced from PubChem (CID 71928443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).