3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one

C15H28N2O2 — CID 62781510

IUPAC3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one
SMILESCOC1CCN(C(=O)CCC2CCC(N)CC2)CC1
InChIInChI=1S/C15H28N2O2/c1-19-14-8-10-17(11-9-14)15(18)7-4-12-2-5-13(16)6-3-12/h12-14H,2-11,16H2,1H3
InChIKeyZRDWACUZDLNJSZ-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.92
Rot. Bonds4

About 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one

3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one (PubChem CID 62781510) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one
PubChem CID62781510
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one
SMILESCOC1CCN(C(=O)CCC2CCC(N)CC2)CC1
InChIInChI=1S/C15H28N2O2/c1-19-14-8-10-17(11-9-14)15(18)7-4-12-2-5-13(16)6-3-12/h12-14H,2-11,16H2,1H3
InChIKeyZRDWACUZDLNJSZ-UHFFFAOYSA-N
XLogP1.92
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one 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

3-(4-aminocyclohexyl)-1-(4-ethylpiperazin-1-yl)propan-1-one
CID 55116653
3-chloro-1-(4-methoxypiperidin-1-yl)propan-1-one
CID 43373029
1-(4-methoxypiperidin-1-yl)pentan-1-one
CID 110725259
2-(cyclopropylmethylamino)-1-(4-methoxypiperidin-1-yl)ethanone;hydrochloride
CID 119697100
5-bromo-1-(4-methoxypiperidin-1-yl)pentan-1-one
CID 107908012
5-amino-1-(4-methoxypiperidin-1-yl)-4-methylpentan-1-one
CID 82017222
3-(4-aminocyclohexyl)-1-(3-methoxy-3-methylpiperidin-1-yl)propan-1-one
CID 107395786
3-cyclopentyl-1-[3-(cyclopropylmethoxy)pyrrolidin-1-yl]propan-1-one
CID 121197558
1-(4-methoxypiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone
CID 112604331
2-(4-aminocyclohexyl)-1-(4-ethoxypiperidin-1-yl)ethanone
CID 55117063
4-(4-methoxypiperidin-1-yl)-2,2-dimethyl-4-oxobutanoic acid
CID 65297955
3-(4-aminocyclohexyl)-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propan-1-one
CID 66370717

Frequently Asked Questions

What is the IUPAC name of 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one?
The IUPAC name of 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one (CID 62781510) is 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one.
What is the SMILES notation for 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one?
The canonical SMILES for 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one is COC1CCN(C(=O)CCC2CCC(N)CC2)CC1.
What is the InChIKey of 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one?
The InChIKey is ZRDWACUZDLNJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-19-14-8-10-17(11-9-14)15(18)7-4-12-2-5-13(16)6-3-12/h12-14H,2-11,16H2,1H3.
What are the key properties of 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one?
3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one has a molecular weight of 268.40 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-aminocyclohexyl)-1-(4-methoxypiperidin-1-yl)propan-1-one is sourced from PubChem (CID 62781510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).