2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one

C14H24N4O2 — CID 119881078

IUPAC2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one
SMILESCNCC(C)C(=O)N1CCOC(Cn2cc(C)cn2)C1
InChIInChI=1S/C14H24N4O2/c1-11-6-16-18(8-11)10-13-9-17(4-5-20-13)14(19)12(2)7-15-3/h6,8,12-13,15H,4-5,7,9-10H2,1-3H3
InChIKeyZDPHZNRAMADLFP-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.27
Rot. Bonds5

About 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one

2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one (PubChem CID 119881078) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one
PubChem CID119881078
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one
SMILESCNCC(C)C(=O)N1CCOC(Cn2cc(C)cn2)C1
InChIInChI=1S/C14H24N4O2/c1-11-6-16-18(8-11)10-13-9-17(4-5-20-13)14(19)12(2)7-15-3/h6,8,12-13,15H,4-5,7,9-10H2,1-3H3
InChIKeyZDPHZNRAMADLFP-UHFFFAOYSA-N
XLogP0.27
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-cyclopentylpropyl)-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide
CID 166203151
N-[(3,3-dimethylcyclohexyl)methyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide
CID 128632413
(2-aminophenyl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone;dihydrochloride
CID 119947134
(3-aminocyclohexyl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone
CID 119881058
1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]-3-(1,2,4-triazol-1-yl)propan-1-one
CID 136525112
(3-aminophenyl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone
CID 119881082
1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]-3-piperidin-3-ylbutan-1-one
CID 119881066
N-[5-methyl-2-(4-methylpyrazol-1-yl)phenyl]-2-[(4-methylpyrazol-1-yl)methyl]morpholine-4-carboxamide
CID 126795527
(4-amino-5-chloro-2-methoxyphenyl)-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone;dihydrochloride
CID 119881097
tert-butyl 2-[(4-aminopyrazol-1-yl)methyl]morpholine-4-carboxylate
CID 118023184
(2R)-2-amino-1-[2-(pyrazol-1-ylmethyl)morpholin-4-yl]propan-1-one
CID 119880996
4-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]pyridine-3-carboxamide
CID 133443384

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one?
The IUPAC name of 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one (CID 119881078) is 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one.
What is the SMILES notation for 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one?
The canonical SMILES for 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one is CNCC(C)C(=O)N1CCOC(Cn2cc(C)cn2)C1.
What is the InChIKey of 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one?
The InChIKey is ZDPHZNRAMADLFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-11-6-16-18(8-11)10-13-9-17(4-5-20-13)14(19)12(2)7-15-3/h6,8,12-13,15H,4-5,7,9-10H2,1-3H3.
What are the key properties of 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one?
2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one has a molecular weight of 280.37 g/mol, XLogP of 0.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(methylamino)-1-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]propan-1-one is sourced from PubChem (CID 119881078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).