N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride

C14H26ClF2N3O — CID 171662917

IUPACN-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride
SMILESCNC1CCN(CC(=O)NC2CCC(F)(F)CC2)CC1.Cl
InChIInChI=1S/C14H25F2N3O.ClH/c1-17-11-4-8-19(9-5-11)10-13(20)18-12-2-6-14(15,16)7-3-12;/h11-12,17H,2-10H2,1H3,(H,18,20);1H
InChIKeyIKYZSCDSWOJJBI-UHFFFAOYSA-N
MW325.83 g/mol
LogP1.79
Rot. Bonds4

About N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride

N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride (PubChem CID 171662917) has the molecular formula C14H26ClF2N3O and a molecular weight of 325.83 g/mol. Its IUPAC name is N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride
PubChem CID171662917
Molecular FormulaC14H26ClF2N3O
Molecular Weight325.83 g/mol
Exact Mass325.17
IUPAC NameN-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride
SMILESCNC1CCN(CC(=O)NC2CCC(F)(F)CC2)CC1.Cl
InChIInChI=1S/C14H25F2N3O.ClH/c1-17-11-4-8-19(9-5-11)10-13(20)18-12-2-6-14(15,16)7-3-12;/h11-12,17H,2-10H2,1H3,(H,18,20);1H
InChIKeyIKYZSCDSWOJJBI-UHFFFAOYSA-N
XLogP1.79
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.83
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride 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

4-[2-(cyclopropylamino)-2-oxoethyl]-N-(4,4-difluorocyclohexyl)piperazine-1-carboxamide
CID 146123613
N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-methylsulfanylpropanamide
CID 47057659
N-(4,4-difluorocyclohexyl)-2-pyrrol-1-ylacetamide
CID 121021883
N-(4,4-difluorocyclohexyl)butanamide
CID 131166223
2-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]acetamide
CID 43704790
2-(4-methylpiperidin-1-yl)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 157336758
2-[4-(methylamino)piperidin-1-yl]-N-(2-methylcyclohexyl)acetamide
CID 119923766
2-[4-(methylamino)piperidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 119923266
N-(3-methylbutan-2-yl)-1-[2-oxo-2-[(1-propan-2-ylpiperidin-4-yl)amino]ethyl]piperidine-4-carboxamide
CID 126769642
N-cyclohexyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922360
1-amino-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]cyclopentane-1-carboxamide;dihydrochloride
CID 119853481
N-cyclooctyl-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119918786

Frequently Asked Questions

What is the IUPAC name of N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride?
The IUPAC name of N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride (CID 171662917) is N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride.
What is the SMILES notation for N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride?
The canonical SMILES for N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride is CNC1CCN(CC(=O)NC2CCC(F)(F)CC2)CC1.Cl.
What is the InChIKey of N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride?
The InChIKey is IKYZSCDSWOJJBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F2N3O.ClH/c1-17-11-4-8-19(9-5-11)10-13(20)18-12-2-6-14(15,16)7-3-12;/h11-12,17H,2-10H2,1H3,(H,18,20);1H.
What are the key properties of N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride?
N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride has a molecular weight of 325.83 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-difluorocyclohexyl)-2-[4-(methylamino)piperidin-1-yl]acetamide;hydrochloride is sourced from PubChem (CID 171662917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).