N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide

C18H25FN2O2 — CID 167782034

IUPACN-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide
SMILESCC(C(=O)NC1CC(c2ccccc2F)C1)N1CCC(O)CC1
InChIInChI=1S/C18H25FN2O2/c1-12(21-8-6-15(22)7-9-21)18(23)20-14-10-13(11-14)16-4-2-3-5-17(16)19/h2-5,12-15,22H,6-11H2,1H3,(H,20,23)
InChIKeyFHVJEESSXPLDHY-UHFFFAOYSA-N
MW320.41 g/mol
LogP2.03
Rot. Bonds4

About N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide

N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide (PubChem CID 167782034) has the molecular formula C18H25FN2O2 and a molecular weight of 320.41 g/mol. Its IUPAC name is N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide
PubChem CID167782034
Molecular FormulaC18H25FN2O2
Molecular Weight320.41 g/mol
Exact Mass320.19
IUPAC NameN-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide
SMILESCC(C(=O)NC1CC(c2ccccc2F)C1)N1CCC(O)CC1
InChIInChI=1S/C18H25FN2O2/c1-12(21-8-6-15(22)7-9-21)18(23)20-14-10-13(11-14)16-4-2-3-5-17(16)19/h2-5,12-15,22H,6-11H2,1H3,(H,20,23)
InChIKeyFHVJEESSXPLDHY-UHFFFAOYSA-N
XLogP2.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-fluorophenyl)cyclobutyl]-1-propan-2-ylpiperidin-4-amine
CID 43634682
N-cyclopropyl-2-[4-(2-fluorobenzoyl)piperazin-1-yl]propanamide
CID 51329108
(2R)-N-cyclopropyl-2-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]propanamide
CID 31688904
N-benzhydryl-2-(4-hydroxypiperidin-1-yl)propanamide
CID 51167538
N-[2-(difluoromethoxy)phenyl]-2-(4-hydroxypiperidin-1-yl)propanamide
CID 51243860
3-[[3-(2-fluorophenyl)cyclobutyl]amino]butanamide
CID 115676927
N-cyclopropyl-2-[4-[2-(2-fluorophenyl)sulfanylacetyl]piperazin-1-yl]propanamide
CID 51329075
2-[(3S)-3-hydroxypyrrolidin-1-yl]-N-phenylpropanamide
CID 78962370
1-[4-(2-fluorophenyl)piperidin-1-yl]ethanethiol
CID 163988464
1-[4-(2-fluorophenyl)piperidin-1-yl]-2-(hydroxycarbamoyl)-3-methylbutane-1-sulfinic acid
CID 91267305
N-(2-aminophenyl)-2-(3-hydroxypyrrolidin-1-yl)propanamide
CID 62942601
ethyl 2-[[3-(2-fluorophenyl)cyclobutyl]amino]propanoate
CID 61498275

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide?
The IUPAC name of N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide (CID 167782034) is N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide.
What is the SMILES notation for N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide?
The canonical SMILES for N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide is CC(C(=O)NC1CC(c2ccccc2F)C1)N1CCC(O)CC1.
What is the InChIKey of N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide?
The InChIKey is FHVJEESSXPLDHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O2/c1-12(21-8-6-15(22)7-9-21)18(23)20-14-10-13(11-14)16-4-2-3-5-17(16)19/h2-5,12-15,22H,6-11H2,1H3,(H,20,23).
What are the key properties of N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide?
N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide has a molecular weight of 320.41 g/mol, XLogP of 2.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-fluorophenyl)cyclobutyl]-2-(4-hydroxypiperidin-1-yl)propanamide is sourced from PubChem (CID 167782034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).