[(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine

C18H28N2O — CID 126446733

IUPAC[(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine
SMILESCC(C)C/C=C(\CN1CCO[C@@H](CN)C1)c1ccccc1
InChIInChI=1S/C18H28N2O/c1-15(2)8-9-17(16-6-4-3-5-7-16)13-20-10-11-21-18(12-19)14-20/h3-7,9,15,18H,8,10-14,19H2,1-2H3/b17-9+/t18-/m0/s1
InChIKeyGGHDJXMHOBQRCS-GONKEYIRSA-N
MW288.44 g/mol
LogP2.78
Rot. Bonds6

About [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine

[(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine (PubChem CID 126446733) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine
PubChem CID126446733
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name[(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine
SMILESCC(C)C/C=C(\CN1CCO[C@@H](CN)C1)c1ccccc1
InChIInChI=1S/C18H28N2O/c1-15(2)8-9-17(16-6-4-3-5-7-16)13-20-10-11-21-18(12-19)14-20/h3-7,9,15,18H,8,10-14,19H2,1-2H3/b17-9+/t18-/m0/s1
InChIKeyGGHDJXMHOBQRCS-GONKEYIRSA-N
XLogP2.78
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(5-methyl-2-phenylhex-2-enyl)morpholin-2-yl]methanamine;dihydrochloride
CID 171149663
[4-(2-phenylprop-2-enyl)morpholin-2-yl]methanamine
CID 114399002
1-methyl-4-[(3R)-1-[(Z)-5-methyl-2-phenylhex-2-enyl]pyrrolidin-3-yl]piperazine
CID 99932282
2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide
CID 61336829
[4-(4-methylpentyl)morpholin-2-yl]methanamine
CID 83157184
2-[2-(aminomethyl)morpholin-4-yl]-N-methyl-N-propan-2-ylacetamide
CID 61337607
2-[2-(aminomethyl)morpholin-4-yl]-N-(3-propan-2-ylphenyl)acetamide
CID 114394898
3-[2-(aminomethyl)morpholin-4-yl]-2-methylpropanamide
CID 61336630
[4-[(4-propan-2-ylphenyl)methyl]morpholin-2-yl]methanamine
CID 61338959
[4-[[4-(2-methylpropyl)morpholin-2-yl]methyl]morpholin-2-yl]methanamine
CID 114398613
2-[2-(aminomethyl)morpholin-4-yl]-N-[(2-fluorophenyl)methyl]-N-methylacetamide
CID 114395074
2-[2-(aminomethyl)morpholin-4-yl]-N-(2-bromophenyl)acetamide
CID 114394940

Frequently Asked Questions

What is the IUPAC name of [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine?
The IUPAC name of [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine (CID 126446733) is [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine.
What is the SMILES notation for [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine?
The canonical SMILES for [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine is CC(C)C/C=C(\CN1CCO[C@@H](CN)C1)c1ccccc1.
What is the InChIKey of [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine?
The InChIKey is GGHDJXMHOBQRCS-GONKEYIRSA-N. The full InChI is InChI=1S/C18H28N2O/c1-15(2)8-9-17(16-6-4-3-5-7-16)13-20-10-11-21-18(12-19)14-20/h3-7,9,15,18H,8,10-14,19H2,1-2H3/b17-9+/t18-/m0/s1.
What are the key properties of [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine?
[(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine has a molecular weight of 288.44 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-4-[(Z)-5-methyl-2-phenylhex-2-enyl]morpholin-2-yl]methanamine is sourced from PubChem (CID 126446733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).