(3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide

C7H13FN2O — CID 129410919

IUPAC(3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide
SMILESCN(C)C(=O)[C@@]1(F)CCNC1
InChIInChI=1S/C7H13FN2O/c1-10(2)6(11)7(8)3-4-9-5-7/h9H,3-5H2,1-2H3/t7-/m1/s1
InChIKeyIODVTOYNGVVRBV-SSDOTTSWSA-N
MW160.19 g/mol
LogP-0.22
Rot. Bonds1

About (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide

(3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide (PubChem CID 129410919) has the molecular formula C7H13FN2O and a molecular weight of 160.19 g/mol. Its IUPAC name is (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide
PubChem CID129410919
Molecular FormulaC7H13FN2O
Molecular Weight160.19 g/mol
Exact Mass160.10
IUPAC Name(3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide
SMILESCN(C)C(=O)[C@@]1(F)CCNC1
InChIInChI=1S/C7H13FN2O/c1-10(2)6(11)7(8)3-4-9-5-7/h9H,3-5H2,1-2H3/t7-/m1/s1
InChIKeyIODVTOYNGVVRBV-SSDOTTSWSA-N
XLogP-0.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.19
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide;hydrochloride
CID 130643464
N-ethyl-3-fluoro-N-methylpyrrolidine-3-carboxamide;hydrochloride
CID 130735533
3-(dimethylamino)-N,N-dimethylpyrrolidine-3-carboxamide
CID 84769822
3-fluoropyrrolidine-3-carboxamide;hydrochloride
CID 130737034
(3S)-3-fluoro-N-[2-(2-fluorophenoxy)ethyl]-N-methylpyrrolidine-3-carboxamide
CID 125146122
(3S)-N-[(2-ethoxyphenyl)methyl]-3-fluoro-N-methylpyrrolidine-3-carboxamide
CID 124588666
N-ethyl-3-fluoropyrrolidine-3-carboxamide;hydrochloride
CID 130629041
(3S)-3-fluoro-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylpyrrolidine-3-carboxamide
CID 125147439
4-methoxy-N,N-dimethylpiperidine-4-carboxamide
CID 84660627
(3S)-3-fluoro-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 129321060
N-(1-ethylcyclobutyl)-3-fluoropyrrolidine-3-carboxamide;hydrochloride
CID 75513772
(3-fluoropyrrolidin-3-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 130747822

Frequently Asked Questions

What is the IUPAC name of (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide?
The IUPAC name of (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide (CID 129410919) is (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide is CN(C)C(=O)[C@@]1(F)CCNC1.
What is the InChIKey of (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide?
The InChIKey is IODVTOYNGVVRBV-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H13FN2O/c1-10(2)6(11)7(8)3-4-9-5-7/h9H,3-5H2,1-2H3/t7-/m1/s1.
What are the key properties of (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide?
(3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide has a molecular weight of 160.19 g/mol, XLogP of -0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-fluoro-N,N-dimethylpyrrolidine-3-carboxamide is sourced from PubChem (CID 129410919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).