4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride

C16H26Cl2FN3O — CID 120565548

IUPAC4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride
SMILESCC(N)CCC(=O)NC1CCCN(c2cccc(F)c2)C1.Cl.Cl
InChIInChI=1S/C16H24FN3O.2ClH/c1-12(18)7-8-16(21)19-14-5-3-9-20(11-14)15-6-2-4-13(17)10-15;;/h2,4,6,10,12,14H,3,5,7-9,11,18H2,1H3,(H,19,21);2*1H
InChIKeyXSLUPVCCCDMLII-UHFFFAOYSA-N
MW366.31 g/mol
LogP2.88
Rot. Bonds5

About 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride

4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride (PubChem CID 120565548) has the molecular formula C16H26Cl2FN3O and a molecular weight of 366.31 g/mol. Its IUPAC name is 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride.

Molecular Properties

Compound Name4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride
PubChem CID120565548
Molecular FormulaC16H26Cl2FN3O
Molecular Weight366.31 g/mol
Exact Mass365.14
IUPAC Name4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride
SMILESCC(N)CCC(=O)NC1CCCN(c2cccc(F)c2)C1.Cl.Cl
InChIInChI=1S/C16H24FN3O.2ClH/c1-12(18)7-8-16(21)19-14-5-3-9-20(11-14)15-6-2-4-13(17)10-15;;/h2,4,6,10,12,14H,3,5,7-9,11,18H2,1H3,(H,19,21);2*1H
InChIKeyXSLUPVCCCDMLII-UHFFFAOYSA-N
XLogP2.88
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.31
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3-fluorophenyl)piperidin-3-yl]-2-methyl-3-(methylamino)propanamide;dihydrochloride
CID 119884155
N-[1-(3-fluorophenyl)piperidin-3-yl]-2-(2-methoxyethylamino)acetamide
CID 119884178
3-amino-N-[1-(3-methoxyphenyl)piperidin-3-yl]butanamide
CID 119884246
N-[1-(3-fluorophenyl)pyrrolidin-3-yl]-4-hydroxybutanamide
CID 110480296
3-amino-N-(1-phenylpiperidin-3-yl)butanamide
CID 119888787
N-[1-(3-fluorophenyl)pyrrolidin-3-yl]-2-methylpropanamide
CID 110478479
N-[1-(3-fluorophenyl)piperidin-3-yl]-2-[2-(methanesulfonamido)phenyl]acetamide
CID 86962189
N-[1-(3-fluorophenyl)pyrrolidin-3-yl]-2-methoxyacetamide
CID 110479175
2-(aminomethyl)-N-[1-(3-fluorophenyl)piperidin-3-yl]-1,3-thiazole-4-carboxamide;dihydrochloride
CID 119884161
N-[(3S)-1-(3-fluorophenyl)piperidin-3-yl]-3-(3-pyrimidin-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 99274476
3-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119884134
1-[1-(3-fluorophenyl)piperidin-3-yl]-3-[1-(1,3-thiazol-2-yl)ethyl]urea
CID 154748763

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride?
The IUPAC name of 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride (CID 120565548) is 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride.
What is the SMILES notation for 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride?
The canonical SMILES for 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride is CC(N)CCC(=O)NC1CCCN(c2cccc(F)c2)C1.Cl.Cl.
What is the InChIKey of 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride?
The InChIKey is XSLUPVCCCDMLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FN3O.2ClH/c1-12(18)7-8-16(21)19-14-5-3-9-20(11-14)15-6-2-4-13(17)10-15;;/h2,4,6,10,12,14H,3,5,7-9,11,18H2,1H3,(H,19,21);2*1H.
What are the key properties of 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride?
4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride has a molecular weight of 366.31 g/mol, XLogP of 2.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[1-(3-fluorophenyl)piperidin-3-yl]pentanamide;dihydrochloride is sourced from PubChem (CID 120565548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).