1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone

C19H37N5O2 — CID 144771309

IUPAC1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone
SMILESCN(CC(=O)N1CCC(N(C)C)CC1)CC(=O)N1CCC(N(C)C)CC1
InChIInChI=1S/C19H37N5O2/c1-20(2)16-6-10-23(11-7-16)18(25)14-22(5)15-19(26)24-12-8-17(9-13-24)21(3)4/h16-17H,6-15H2,1-5H3
InChIKeyXNLKJHSIBFHETF-UHFFFAOYSA-N
MW367.54 g/mol
LogP0.02
Rot. Bonds6

About 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone

1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone (PubChem CID 144771309) has the molecular formula C19H37N5O2 and a molecular weight of 367.54 g/mol. Its IUPAC name is 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone.

Molecular Properties

Compound Name1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone
PubChem CID144771309
Molecular FormulaC19H37N5O2
Molecular Weight367.54 g/mol
Exact Mass367.29
IUPAC Name1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone
SMILESCN(CC(=O)N1CCC(N(C)C)CC1)CC(=O)N1CCC(N(C)C)CC1
InChIInChI=1S/C19H37N5O2/c1-20(2)16-6-10-23(11-7-16)18(25)14-22(5)15-19(26)24-12-8-17(9-13-24)21(3)4/h16-17H,6-15H2,1-5H3
InChIKeyXNLKJHSIBFHETF-UHFFFAOYSA-N
XLogP0.02
TPSA50.34 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.54
LogP ≤ 50.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone with MolForge

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Related Compounds

tris(1-[4-(dimethylamino)piperidin-1-yl]butane-1,3-dione);iron(3+)
CID 53467781
2-[methyl-(2-oxo-2-piperidin-1-ylethyl)amino]-1-piperidin-1-ylethanone
CID 58826563
1-[4-(dimethylamino)piperidin-1-yl]ethanone;propane
CID 143677842
1-[2-[(2-amino-2-oxoethyl)-methylamino]acetyl]piperidine-4-carboxylic acid
CID 62658956
2-[2-bromoprop-2-enyl(methyl)amino]-1-(4-hydroxypiperidin-1-yl)ethanone
CID 111781062
3-(aminomethyl)-1-[4-(dimethylamino)piperidin-1-yl]pentan-1-one
CID 81071625
4-(dimethylamino)-N,N-dimethylpiperidine-1-carboxamide
CID 110470375
2-[4-(dimethylamino)piperidin-1-yl]-2-oxoacetic acid
CID 43586380
1-[3-(dimethylamino)pyrrolidin-1-yl]-2-[methyl(methylamino)amino]ethanone
CID 177006682
2-[2-hydroxypropyl(methyl)amino]-1-(4-methylpiperidin-1-yl)ethanone
CID 62332786
2-[[2-[4-(hydrazinecarbonyl)piperidin-1-yl]-2-oxoethyl]-methylamino]acetamide
CID 63574037
4-(dimethylamino)piperidine-1-carbonyl chloride;hydrochloride
CID 155821051

Frequently Asked Questions

What is the IUPAC name of 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone?
The IUPAC name of 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone (CID 144771309) is 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone.
What is the SMILES notation for 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone?
The canonical SMILES for 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone is CN(CC(=O)N1CCC(N(C)C)CC1)CC(=O)N1CCC(N(C)C)CC1.
What is the InChIKey of 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone?
The InChIKey is XNLKJHSIBFHETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37N5O2/c1-20(2)16-6-10-23(11-7-16)18(25)14-22(5)15-19(26)24-12-8-17(9-13-24)21(3)4/h16-17H,6-15H2,1-5H3.
What are the key properties of 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone?
1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone has a molecular weight of 367.54 g/mol, XLogP of 0.02, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(dimethylamino)piperidin-1-yl]-2-[[2-[4-(dimethylamino)piperidin-1-yl]-2-oxoethyl]-methylamino]ethanone is sourced from PubChem (CID 144771309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).