2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide

C14H28N4O2 — CID 60937695

IUPAC2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide
SMILESCCCCC(N)C(=O)N1CCN(CC(=O)N(C)C)CC1
InChIInChI=1S/C14H28N4O2/c1-4-5-6-12(15)14(20)18-9-7-17(8-10-18)11-13(19)16(2)3/h12H,4-11,15H2,1-3H3
InChIKeyFREUZTXYCWBVDQ-UHFFFAOYSA-N
MW284.40 g/mol
LogP-0.26
Rot. Bonds6

About 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide

2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide (PubChem CID 60937695) has the molecular formula C14H28N4O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide
PubChem CID60937695
Molecular FormulaC14H28N4O2
Molecular Weight284.40 g/mol
Exact Mass284.22
IUPAC Name2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide
SMILESCCCCC(N)C(=O)N1CCN(CC(=O)N(C)C)CC1
InChIInChI=1S/C14H28N4O2/c1-4-5-6-12(15)14(20)18-9-7-17(8-10-18)11-13(19)16(2)3/h12H,4-11,15H2,1-3H3
InChIKeyFREUZTXYCWBVDQ-UHFFFAOYSA-N
XLogP-0.26
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-1-(4-propylpiperazin-1-yl)hexan-1-one
CID 60854021
2-[4-[(2R)-2-amino-4-methylsulfanylbutanoyl]piperazin-1-yl]-N,N-dimethylacetamide
CID 104907616
(2S)-2-amino-1-[4-(2-hydroxyethyl)piperazin-1-yl]hexan-1-one
CID 93339973
2-amino-1-[4-(2-methylpropanoyl)piperazin-1-yl]hexan-1-one
CID 54870104
2-[4-[(2R)-2-amino-3,3-dimethylbutanoyl]piperazin-1-yl]-N,N-dimethylacetamide
CID 103929106
1-[(2S)-2-aminohexanoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 93370949
2-amino-1-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]hexan-1-one
CID 107218240
4-[(2S)-2-aminopentanoyl]-N,N-dimethylpiperazine-1-carboxamide
CID 93373838
4-(2-aminopentanoyl)-N,N-dimethylpiperazine-1-carboxamide
CID 54872852
(2S)-2-amino-1-(4-methyl-1,4-diazepan-1-yl)hexan-1-one
CID 93315574
(2S)-2-amino-1-[4-(3-methylbutanoyl)piperazin-1-yl]hexan-1-one
CID 103831201
2-[4-[2-(aminomethyl)pentanoyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 65227502

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide?
The IUPAC name of 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide (CID 60937695) is 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide?
The canonical SMILES for 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide is CCCCC(N)C(=O)N1CCN(CC(=O)N(C)C)CC1.
What is the InChIKey of 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide?
The InChIKey is FREUZTXYCWBVDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O2/c1-4-5-6-12(15)14(20)18-9-7-17(8-10-18)11-13(19)16(2)3/h12H,4-11,15H2,1-3H3.
What are the key properties of 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide?
2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide has a molecular weight of 284.40 g/mol, XLogP of -0.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminohexanoyl)piperazin-1-yl]-N,N-dimethylacetamide is sourced from PubChem (CID 60937695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).