N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride

C7H14ClFN2O — CID 87325134

IUPACN-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCCF)C1CCNC1
InChIInChI=1S/C7H13FN2O.ClH/c8-2-4-10-7(11)6-1-3-9-5-6;/h6,9H,1-5H2,(H,10,11);1H
InChIKeyJFPAWPXZQAVNAZ-UHFFFAOYSA-N
MW196.65 g/mol
LogP0.10
Rot. Bonds3

About N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride

N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride (PubChem CID 87325134) has the molecular formula C7H14ClFN2O and a molecular weight of 196.65 g/mol. Its IUPAC name is N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
PubChem CID87325134
Molecular FormulaC7H14ClFN2O
Molecular Weight196.65 g/mol
Exact Mass196.08
IUPAC NameN-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
SMILESCl.O=C(NCCF)C1CCNC1
InChIInChI=1S/C7H13FN2O.ClH/c8-2-4-10-7(11)6-1-3-9-5-6;/h6,9H,1-5H2,(H,10,11);1H
InChIKeyJFPAWPXZQAVNAZ-UHFFFAOYSA-N
XLogP0.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.65
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluoroethyl)pyrrolidine-3-carboxamide
CID 76624204
N-(4,4,4-trifluorobutyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119781584
(3S)-N-(2-methoxyethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 165429633
N-tetradecylpyrrolidine-3-carboxamide;hydrochloride
CID 154586688
(3S)-N-(2-amino-2-oxoethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130670847
N-(5-amino-5-oxopentyl)pyrrolidine-3-carboxamide
CID 106235636
(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide
CID 131181581
(3S)-N-(2-methylpropyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130617113
7-(pyrrolidine-3-carbonylamino)heptanoic acid
CID 63005734
N-hex-5-ynylpyrrolidine-3-carboxamide
CID 106213094
N-[2-(cycloheptylamino)ethyl]pyrrolidine-3-carboxamide
CID 122080782
N-pent-3-ynylpyrrolidine-3-carboxamide
CID 116644143

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
The IUPAC name of N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride (CID 87325134) is N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
The canonical SMILES for N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride is Cl.O=C(NCCF)C1CCNC1.
What is the InChIKey of N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
The InChIKey is JFPAWPXZQAVNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13FN2O.ClH/c8-2-4-10-7(11)6-1-3-9-5-6;/h6,9H,1-5H2,(H,10,11);1H.
What are the key properties of N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride?
N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride has a molecular weight of 196.65 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride is sourced from PubChem (CID 87325134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).