N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide

C14H18F2N2O2 — CID 30101240

IUPACN-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
SMILESO=C(CCN1CCC(O)CC1)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H18F2N2O2/c15-12-2-1-10(9-13(12)16)17-14(20)5-8-18-6-3-11(19)4-7-18/h1-2,9,11,19H,3-8H2,(H,17,20)
InChIKeySCTIDKKXFBDKNH-UHFFFAOYSA-N
MW284.31 g/mol
LogP1.75
Rot. Bonds4

About N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide

N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide (PubChem CID 30101240) has the molecular formula C14H18F2N2O2 and a molecular weight of 284.31 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
PubChem CID30101240
Molecular FormulaC14H18F2N2O2
Molecular Weight284.31 g/mol
Exact Mass284.13
IUPAC NameN-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
SMILESO=C(CCN1CCC(O)CC1)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H18F2N2O2/c15-12-2-1-10(9-13(12)16)17-14(20)5-8-18-6-3-11(19)4-7-18/h1-2,9,11,19H,3-8H2,(H,17,20)
InChIKeySCTIDKKXFBDKNH-UHFFFAOYSA-N
XLogP1.75
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(azepan-1-yl)-N-(3,4-difluorophenyl)propanamide;hydrochloride
CID 90483211
N-(3,4-difluorophenyl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propanamide
CID 719526
N-(3-fluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide
CID 43037946
N-(3-amino-4-fluorophenyl)-3-(3-hydroxypyrrolidin-1-yl)propanamide
CID 55131164
ethyl 1-[3-(3,4-difluoroanilino)-3-oxopropyl]piperidine-4-carboxylate
CID 739948
N-(3,4-difluorophenyl)-3-(3-methylpiperidin-1-yl)propanamide
CID 3145276
N-(5-chloro-2-pyridinyl)-1-[3-(3,4-difluoroanilino)-3-oxopropyl]piperidine-4-carboxamide
CID 56525544
N-(3-amino-4-fluorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 16778601
N-[1-[3-(3,4-difluoroanilino)-3-oxopropyl]piperidin-4-yl]thiophene-3-carboxamide
CID 47549640
N-(3,4-difluorophenyl)-3-[4-(2,3-dihydro-1,4-benzodioxine-6-carbonyl)piperidin-1-yl]propanamide
CID 33215602
N-(3,4-difluorophenyl)-3-pyrrol-1-ylpropanamide
CID 110688754
N,N'-bis(3,4-difluorophenyl)butanediamide
CID 896186

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide?
The IUPAC name of N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide (CID 30101240) is N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide?
The canonical SMILES for N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide is O=C(CCN1CCC(O)CC1)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide?
The InChIKey is SCTIDKKXFBDKNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O2/c15-12-2-1-10(9-13(12)16)17-14(20)5-8-18-6-3-11(19)4-7-18/h1-2,9,11,19H,3-8H2,(H,17,20).
What are the key properties of N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide?
N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide has a molecular weight of 284.31 g/mol, XLogP of 1.75, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-3-(4-hydroxypiperidin-1-yl)propanamide is sourced from PubChem (CID 30101240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).