2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone

C15H29N3O — CID 81459405

IUPAC2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone
SMILESCCC1CN(CC(=O)N2CCC(C)CC2)CCC1N
InChIInChI=1S/C15H29N3O/c1-3-13-10-17(7-6-14(13)16)11-15(19)18-8-4-12(2)5-9-18/h12-14H,3-11,16H2,1-2H3
InChIKeyLGOIIESWUOPQKI-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.30
Rot. Bonds3

About 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone

2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone (PubChem CID 81459405) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone
PubChem CID81459405
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone
SMILESCCC1CN(CC(=O)N2CCC(C)CC2)CCC1N
InChIInChI=1S/C15H29N3O/c1-3-13-10-17(7-6-14(13)16)11-15(19)18-8-4-12(2)5-9-18/h12-14H,3-11,16H2,1-2H3
InChIKeyLGOIIESWUOPQKI-UHFFFAOYSA-N
XLogP1.30
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-amino-3-ethylpiperidin-1-yl)-1-(2-methylpiperidin-1-yl)ethanone
CID 81458745
1-[(3R,4S)-4-amino-3-ethylpiperidin-1-yl]propan-1-one
CID 96581961
methyl 2-(4-amino-3-ethylpiperidin-1-yl)acetate
CID 81460463
methyl 1-[2-(4-amino-3-methylpiperidin-1-yl)acetyl]piperidine-4-carboxylate
CID 79874187
1-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]imidazolidin-2-one
CID 81459873
4-amino-3-ethylpiperidine-1-carboxylic acid
CID 90001260
2-(4-methylpiperidin-1-yl)-1-pyrrolidin-1-ylethanone
CID 39903910
2-(4-amino-3-ethylpiperidin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 81458982
1-(4-ethylpiperazin-1-yl)-2-(4-methylpiperidin-1-yl)ethanone
CID 59555423
methyl N-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]carbamate
CID 81460877
2-(4-amino-3-ethylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
CID 81460476
2-[4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]acetic acid
CID 43521829

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone (CID 81459405) is 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone is CCC1CN(CC(=O)N2CCC(C)CC2)CCC1N.
What is the InChIKey of 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone?
The InChIKey is LGOIIESWUOPQKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-3-13-10-17(7-6-14(13)16)11-15(19)18-8-4-12(2)5-9-18/h12-14H,3-11,16H2,1-2H3.
What are the key properties of 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone?
2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone has a molecular weight of 267.42 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-ethylpiperidin-1-yl)-1-(4-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 81459405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).