[2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone

C15H22N2O2 — CID 61336812

IUPAC[2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)N2CCOC(CN)C2)c(C)c1
InChIInChI=1S/C15H22N2O2/c1-10-6-11(2)14(12(3)7-10)15(18)17-4-5-19-13(8-16)9-17/h6-7,13H,4-5,8-9,16H2,1-3H3
InChIKeyQYLIASAQSDCGKV-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.41
Rot. Bonds2

About [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone

[2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone (PubChem CID 61336812) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone
PubChem CID61336812
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name[2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)N2CCOC(CN)C2)c(C)c1
InChIInChI=1S/C15H22N2O2/c1-10-6-11(2)14(12(3)7-10)15(18)17-4-5-19-13(8-16)9-17/h6-7,13H,4-5,8-9,16H2,1-3H3
InChIKeyQYLIASAQSDCGKV-UHFFFAOYSA-N
XLogP1.41
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4,6-trimethylbenzoyl)morpholine-2-carbothioamide
CID 79674045
[2-(aminomethyl)morpholin-4-yl]-(3-methyl-5-nitrophenyl)methanone
CID 114398165
[2-(aminomethyl)morpholin-4-yl]-(3,5-dihydroxyphenyl)methanone
CID 107702086
[2-(aminomethyl)morpholin-4-yl]-(5-chloro-2-methylphenyl)methanone
CID 114398222
[2-(aminomethyl)morpholin-4-yl]-(2-bromo-3-methylphenyl)methanone
CID 107983238
[2-(aminomethyl)morpholin-4-yl]-(5-methylpyrazolo[1,5-a]pyridin-2-yl)methanone
CID 122557782
[2-(bromomethyl)morpholin-4-yl]-(3,5-dimethylphenyl)methanone
CID 81210603
[(2R)-2-(aminomethyl)morpholin-4-yl]-(4-fluorophenyl)methanone
CID 42252437
[(2S)-2-(aminomethyl)morpholin-4-yl]-(4-methoxyphenyl)methanone
CID 42252495
2-(aminomethyl)-N-(3-methylphenyl)morpholine-4-carboxamide
CID 61337014
[2-(aminomethyl)morpholin-4-yl]-(3-ethyl-1-methylpyrazol-5-yl)methanone
CID 66121292
2-(aminomethyl)-N-ethylmorpholine-4-carboxamide
CID 61337795

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone (CID 61336812) is [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone is Cc1cc(C)c(C(=O)N2CCOC(CN)C2)c(C)c1.
What is the InChIKey of [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone?
The InChIKey is QYLIASAQSDCGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-6-11(2)14(12(3)7-10)15(18)17-4-5-19-13(8-16)9-17/h6-7,13H,4-5,8-9,16H2,1-3H3.
What are the key properties of [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone?
[2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone has a molecular weight of 262.35 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)morpholin-4-yl]-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 61336812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).