N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide

C18H32N4O4 — CID 55541672

IUPACN-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
SMILESCC(=O)C(NC(=O)CN1CCN(C(=O)CN2CCOCC2)CC1)C(C)C
InChIInChI=1S/C18H32N4O4/c1-14(2)18(15(3)23)19-16(24)12-20-4-6-22(7-5-20)17(25)13-21-8-10-26-11-9-21/h14,18H,4-13H2,1-3H3,(H,19,24)
InChIKeyRXNWFMVRYOSXPA-UHFFFAOYSA-N
MW368.48 g/mol
LogP-0.81
Rot. Bonds7

About N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide

N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide (PubChem CID 55541672) has the molecular formula C18H32N4O4 and a molecular weight of 368.48 g/mol. Its IUPAC name is N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
PubChem CID55541672
Molecular FormulaC18H32N4O4
Molecular Weight368.48 g/mol
Exact Mass368.24
IUPAC NameN-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide
SMILESCC(=O)C(NC(=O)CN1CCN(C(=O)CN2CCOCC2)CC1)C(C)C
InChIInChI=1S/C18H32N4O4/c1-14(2)18(15(3)23)19-16(24)12-20-4-6-22(7-5-20)17(25)13-21-8-10-26-11-9-21/h14,18H,4-13H2,1-3H3,(H,19,24)
InChIKeyRXNWFMVRYOSXPA-UHFFFAOYSA-N
XLogP-0.81
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 5-0.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide with MolForge

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Related Compounds

N-(2-methyl-4-oxopentan-3-yl)-2-(4-propylpiperazin-1-yl)acetamide
CID 43234442
(2R)-2-amino-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]propan-1-one
CID 119840052
2-morpholin-4-yl-1-[4-(2-propan-2-yloxyethyl)piperazin-1-yl]ethanone
CID 55506472
2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]-N-prop-2-enylacetamide
CID 55498763
N,N-dimethyl-4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carboxamide
CID 52542447
N-(4-hydroxybutan-2-yl)-2-morpholin-4-ylacetamide
CID 110011691
2-morpholin-4-yl-N-(2-morpholin-4-yl-2-oxoethyl)acetamide
CID 86019043
N-(2-methyl-4-oxopentan-3-yl)-2-[4-(methylsulfamoylamino)piperidin-1-yl]acetamide
CID 139004941
potassium (2S)-2-[(2-morpholin-4-ylacetyl)amino]propanoate
CID 131737033
4-amino-1-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]pentan-1-one;dihydrochloride
CID 120564429
2-(4-tert-butylpiperidin-1-yl)-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 62091095
(2S)-2-amino-4-methyl-1-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]pentan-1-one;dihydrochloride
CID 119834293

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
The IUPAC name of N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide (CID 55541672) is N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide.
What is the SMILES notation for N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
The canonical SMILES for N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide is CC(=O)C(NC(=O)CN1CCN(C(=O)CN2CCOCC2)CC1)C(C)C.
What is the InChIKey of N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
The InChIKey is RXNWFMVRYOSXPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O4/c1-14(2)18(15(3)23)19-16(24)12-20-4-6-22(7-5-20)17(25)13-21-8-10-26-11-9-21/h14,18H,4-13H2,1-3H3,(H,19,24).
What are the key properties of N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide?
N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide has a molecular weight of 368.48 g/mol, XLogP of -0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-oxopentan-3-yl)-2-[4-(2-morpholin-4-ylacetyl)piperazin-1-yl]acetamide is sourced from PubChem (CID 55541672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).