N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane

C17H36N4O — CID 142367549

IUPACN,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane
SMILESCC.CN(C)C(=O)CN1CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C15H30N4O.C2H6/c1-16(2)15(20)14-19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17;1-2/h3-14H2,1-2H3;1-2H3
InChIKeyPZICEMXZIDEYSO-UHFFFAOYSA-N
MW312.50 g/mol
LogP1.20
Rot. Bonds5

About N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane

N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane (PubChem CID 142367549) has the molecular formula C17H36N4O and a molecular weight of 312.50 g/mol. Its IUPAC name is N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane.

Molecular Properties

Compound NameN,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane
PubChem CID142367549
Molecular FormulaC17H36N4O
Molecular Weight312.50 g/mol
Exact Mass312.29
IUPAC NameN,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane
SMILESCC.CN(C)C(=O)CN1CCN(CCN2CCCCC2)CC1
InChIInChI=1S/C15H30N4O.C2H6/c1-16(2)15(20)14-19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17;1-2/h3-14H2,1-2H3;1-2H3
InChIKeyPZICEMXZIDEYSO-UHFFFAOYSA-N
XLogP1.20
TPSA30.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.50
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azetidin-1-yl)-N,N-dimethylacetamide
CID 69256971
2-[4-(5-hydroxypentyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 110923804
2-(4-acetyl-1,4-diazepan-1-yl)-N,N-dimethylacetamide
CID 60699636
N,N-dimethyl-2-(4-methylpiperidin-1-yl)acetamide;ethane
CID 145317125
2-[4-[(2R)-2-hydroxybutyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 111487415
N,N-dimethyl-2-(4-sulfamoylpiperazin-1-yl)acetamide
CID 112683880
2-(4-aminoazepan-1-yl)-N,N-dimethylacetamide
CID 127011721
2-[4-(4-hydroxybutanoyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 79204679
2-[4-(chloromethylsulfonyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide
CID 55246213
N,N-dimethyl-2-(4-propan-2-ylsulfonyl-1,4-diazepan-1-yl)acetamide
CID 61355697
2-(4,4-dimethylpiperidin-1-yl)-N,N-dimethylacetamide
CID 127272826
2-[4-(cycloheptylamino)piperidin-1-yl]-N,N-dimethylacetamide
CID 43767045

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane?
The IUPAC name of N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane (CID 142367549) is N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane.
What is the SMILES notation for N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane?
The canonical SMILES for N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane is CC.CN(C)C(=O)CN1CCN(CCN2CCCCC2)CC1.
What is the InChIKey of N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane?
The InChIKey is PZICEMXZIDEYSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O.C2H6/c1-16(2)15(20)14-19-12-10-18(11-13-19)9-8-17-6-4-3-5-7-17;1-2/h3-14H2,1-2H3;1-2H3.
What are the key properties of N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane?
N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane has a molecular weight of 312.50 g/mol, XLogP of 1.20, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[4-(2-piperidin-1-ylethyl)piperazin-1-yl]acetamide;ethane is sourced from PubChem (CID 142367549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).