N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride

C14H20ClFN2O2 — CID 119335715

IUPACN-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCC(CNC(=O)C1CCCN1)Oc1ccccc1F.Cl
InChIInChI=1S/C14H19FN2O2.ClH/c1-10(19-13-7-3-2-5-11(13)15)9-17-14(18)12-6-4-8-16-12;/h2-3,5,7,10,12,16H,4,6,8-9H2,1H3,(H,17,18);1H
InChIKeyJAFDHQIZEDBZMV-UHFFFAOYSA-N
MW302.78 g/mol
LogP1.88
Rot. Bonds5

About N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride

N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride (PubChem CID 119335715) has the molecular formula C14H20ClFN2O2 and a molecular weight of 302.78 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride
PubChem CID119335715
Molecular FormulaC14H20ClFN2O2
Molecular Weight302.78 g/mol
Exact Mass302.12
IUPAC NameN-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride
SMILESCC(CNC(=O)C1CCCN1)Oc1ccccc1F.Cl
InChIInChI=1S/C14H19FN2O2.ClH/c1-10(19-13-7-3-2-5-11(13)15)9-17-14(18)12-6-4-8-16-12;/h2-3,5,7,10,12,16H,4,6,8-9H2,1H3,(H,17,18);1H
InChIKeyJAFDHQIZEDBZMV-UHFFFAOYSA-N
XLogP1.88
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.78
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenoxypropyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119295521
N-[2-(2-fluorophenoxy)propyl]morpholine-3-carboxamide
CID 119804849
N-(2-phenoxypropyl)pyrrolidine-2-carboxamide
CID 119295522
N-[2-(2-fluorophenoxy)ethyl]pyrrolidine-2-carboxamide
CID 110481245
N-[2-(3-methylphenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119335744
N-[2-(3-chlorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119336985
9-amino-N-[2-(2-fluorophenoxy)propyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120991075
N-[(2-propan-2-yloxyphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119280684
N-(2-phenylsulfanylpropyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119335474
2-(2,5-dimethylpyrrolidin-1-yl)-N-[2-(2-fluorophenoxy)propyl]propanamide
CID 75423099
N-[2-[2-(trifluoromethyl)phenoxy]butyl]pyrrolidine-2-carboxamide
CID 119344757
(2S)-N-[[2-(difluoromethoxy)phenyl]methyl]pyrrolidine-2-carboxamide
CID 61252076

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride (CID 119335715) is N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride is CC(CNC(=O)C1CCCN1)Oc1ccccc1F.Cl.
What is the InChIKey of N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride?
The InChIKey is JAFDHQIZEDBZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O2.ClH/c1-10(19-13-7-3-2-5-11(13)15)9-17-14(18)12-6-4-8-16-12;/h2-3,5,7,10,12,16H,4,6,8-9H2,1H3,(H,17,18);1H.
What are the key properties of N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride?
N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride has a molecular weight of 302.78 g/mol, XLogP of 1.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)propyl]pyrrolidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119335715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).