2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide

C14H28N4O2 — CID 95901676

IUPAC2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide
SMILESCCN1CCN(C(=O)[C@@H](C)N(C)CC(=O)N(C)C)CC1
InChIInChI=1S/C14H28N4O2/c1-6-17-7-9-18(10-8-17)14(20)12(2)16(5)11-13(19)15(3)4/h12H,6-11H2,1-5H3/t12-/m1/s1
InChIKeyZCFFEQDGUDVTQP-GFCCVEGCSA-N
MW284.40 g/mol
LogP-0.44
Rot. Bonds5

About 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide

2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide (PubChem CID 95901676) has the molecular formula C14H28N4O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide
PubChem CID95901676
Molecular FormulaC14H28N4O2
Molecular Weight284.40 g/mol
Exact Mass284.22
IUPAC Name2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide
SMILESCCN1CCN(C(=O)[C@@H](C)N(C)CC(=O)N(C)C)CC1
InChIInChI=1S/C14H28N4O2/c1-6-17-7-9-18(10-8-17)14(20)12(2)16(5)11-13(19)15(3)4/h12H,6-11H2,1-5H3/t12-/m1/s1
InChIKeyZCFFEQDGUDVTQP-GFCCVEGCSA-N
XLogP-0.44
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 5-0.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide with MolForge

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Related Compounds

N,N-dimethyl-2-[methyl-(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]acetamide
CID 78809290
3-[[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]propanoic acid
CID 119911103
N-[2-[[1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]ethyl]-2-methylpropanamide
CID 75396645
1-(4-ethylpiperazin-1-yl)-2-methylpropan-1-one
CID 4069425
1-(4-ethylpiperazin-1-yl)-2-[(2-hydroxycyclopentyl)methyl-methylamino]propan-1-one
CID 109397804
2-[(2-chlorophenyl)methyl-methylamino]-1-(4-ethylpiperazin-1-yl)propan-1-one
CID 78786364
1-(4-ethylpiperazin-1-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]propan-1-one
CID 78786374
N-(3,4-dichlorophenyl)-2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]acetamide
CID 9198085
(2S)-2-chloro-1-(4-ethylpiperazin-1-yl)propan-1-one
CID 7986281
2-chloro-1-(4-ethylpiperazin-1-yl)propan-1-one
CID 5149334
2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 9286389
2-amino-1-(4-ethyl-1,4-diazepan-1-yl)propan-1-one
CID 83635043

Frequently Asked Questions

What is the IUPAC name of 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide (CID 95901676) is 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide is CCN1CCN(C(=O)[C@@H](C)N(C)CC(=O)N(C)C)CC1.
What is the InChIKey of 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide?
The InChIKey is ZCFFEQDGUDVTQP-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H28N4O2/c1-6-17-7-9-18(10-8-17)14(20)12(2)16(5)11-13(19)15(3)4/h12H,6-11H2,1-5H3/t12-/m1/s1.
What are the key properties of 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide?
2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide has a molecular weight of 284.40 g/mol, XLogP of -0.44, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2R)-1-(4-ethylpiperazin-1-yl)-1-oxopropan-2-yl]-methylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 95901676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).