2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone

C16H30N2O — CID 83061947

IUPAC2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone
SMILESCCCC1CCCCN1C(=O)CC1CCCCC1N
InChIInChI=1S/C16H30N2O/c1-2-7-14-9-5-6-11-18(14)16(19)12-13-8-3-4-10-15(13)17/h13-15H,2-12,17H2,1H3
InChIKeyNGMNDIUHWYKUNO-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.08
Rot. Bonds4

About 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone

2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone (PubChem CID 83061947) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone
PubChem CID83061947
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone
SMILESCCCC1CCCCN1C(=O)CC1CCCCC1N
InChIInChI=1S/C16H30N2O/c1-2-7-14-9-5-6-11-18(14)16(19)12-13-8-3-4-10-15(13)17/h13-15H,2-12,17H2,1H3
InChIKeyNGMNDIUHWYKUNO-UHFFFAOYSA-N
XLogP3.08
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-aminocyclohexyl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 55116461
2-bromo-1-(2-propylpiperidin-1-yl)ethanone
CID 83053246
2-(2-aminocyclohexyl)-1-(3-ethylmorpholin-4-yl)ethanone
CID 62782698
2-propylpiperidine-1-carbothioamide
CID 83053270
1-(2-propylpiperidin-1-yl)-2-(prop-2-ynylamino)ethanone
CID 83053784
6-oxo-6-(2-propylpiperidin-1-yl)hexanoic acid
CID 83052295
1-[2-(2-aminoethyl)piperidin-1-yl]butan-1-one
CID 63754291
2-amino-2-methyl-1-(2-propylpiperidin-1-yl)propan-1-one
CID 83053484
cyclopentyl 2-propylpiperidine-1-carboxylate
CID 112738861
3-bicyclo[3.1.0]hexanyl-(2-propylpiperidin-1-yl)methanone
CID 83056790
2-amino-2-cyclopropyl-1-(2-propylpiperidin-1-yl)propan-1-one
CID 83053178
methyl N-[2-oxo-2-(2-propylpyrrolidin-1-yl)ethyl]carbamate
CID 144841415

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone?
The IUPAC name of 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone (CID 83061947) is 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone is CCCC1CCCCN1C(=O)CC1CCCCC1N.
What is the InChIKey of 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone?
The InChIKey is NGMNDIUHWYKUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-2-7-14-9-5-6-11-18(14)16(19)12-13-8-3-4-10-15(13)17/h13-15H,2-12,17H2,1H3.
What are the key properties of 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone?
2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone has a molecular weight of 266.43 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminocyclohexyl)-1-(2-propylpiperidin-1-yl)ethanone is sourced from PubChem (CID 83061947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).