1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone

C15H29N3O — CID 54874227

IUPAC1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone
SMILESCC(C)NCC(=O)N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C15H29N3O/c1-13(2)16-12-15(19)18-10-6-14(7-11-18)17-8-4-3-5-9-17/h13-14,16H,3-12H2,1-2H3
InChIKeyWGOYNGZYXCDPQJ-UHFFFAOYSA-N
MW267.42 g/mol
LogP1.46
Rot. Bonds4

About 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone

1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone (PubChem CID 54874227) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone.

Molecular Properties

Compound Name1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone
PubChem CID54874227
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone
SMILESCC(C)NCC(=O)N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C15H29N3O/c1-13(2)16-12-15(19)18-10-6-14(7-11-18)17-8-4-3-5-9-17/h13-14,16H,3-12H2,1-2H3
InChIKeyWGOYNGZYXCDPQJ-UHFFFAOYSA-N
XLogP1.46
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-piperidin-1-ylpiperidin-1-yl)butane-1,3-dione
CID 60950466
N-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]acetamide
CID 113402232
4-piperidin-1-yl-N-propan-2-ylpiperidine-1-carboxamide
CID 115582950
2-aminooxy-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone
CID 71196964
1-[1-[2-(propan-2-ylamino)acetyl]piperidin-4-yl]pyrrolidine-2-carboxylic acid
CID 61159988
2-(prop-2-enylamino)-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone
CID 79280161
2-anilino-1-(4-piperidin-1-ylpiperidin-1-yl)ethanone;dihydrochloride
CID 119842954
N'-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)-3-piperidin-1-ylpyrrolidine-1-carboximidamide
CID 119143060
N'-methyl-N-(2-oxo-2-piperidin-1-ylethyl)-3-piperidin-1-ylpyrrolidine-1-carboximidamide
CID 119143190
2-(ethylamino)-1-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanone
CID 63167256
N-(3-hydroxypropyl)-1-[2-(propan-2-ylamino)acetyl]piperidine-4-carboxamide
CID 60953607
3-methyl-1-[4-[4-(piperidine-1-carbonyl)piperidin-1-yl]piperidin-1-yl]butan-1-one
CID 42693420

Frequently Asked Questions

What is the IUPAC name of 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
The IUPAC name of 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone (CID 54874227) is 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone.
What is the SMILES notation for 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
The canonical SMILES for 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone is CC(C)NCC(=O)N1CCC(N2CCCCC2)CC1.
What is the InChIKey of 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
The InChIKey is WGOYNGZYXCDPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-13(2)16-12-15(19)18-10-6-14(7-11-18)17-8-4-3-5-9-17/h13-14,16H,3-12H2,1-2H3.
What are the key properties of 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone?
1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone has a molecular weight of 267.42 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-piperidin-1-ylpiperidin-1-yl)-2-(propan-2-ylamino)ethanone is sourced from PubChem (CID 54874227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).