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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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).