3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide

C15H19FN2O2 — CID 121197683

IUPAC3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC(OCC2CC2)C1
InChIInChI=1S/C15H19FN2O2/c16-13-3-1-2-4-14(13)17-15(19)18-8-7-12(9-18)20-10-11-5-6-11/h1-4,11-12H,5-10H2,(H,17,19)
InChIKeyQKCHZMGJQNBIQZ-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.86
Rot. Bonds4

About 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide

3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide (PubChem CID 121197683) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide
PubChem CID121197683
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCC(OCC2CC2)C1
InChIInChI=1S/C15H19FN2O2/c16-13-3-1-2-4-14(13)17-15(19)18-8-7-12(9-18)20-10-11-5-6-11/h1-4,11-12H,5-10H2,(H,17,19)
InChIKeyQKCHZMGJQNBIQZ-UHFFFAOYSA-N
XLogP2.86
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-3-(cyclopropylmethoxy)pyrrolidine-1-carboxamide
CID 121197665
3-(cyclopropylmethoxy)-N-[2-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 121197684
[3-(cyclopropylmethoxy)pyrrolidin-1-yl]-(2,6-difluorophenyl)methanone
CID 121197502
3-(cyclopropylmethoxy)-N-quinolin-8-ylpyrrolidine-1-carboxamide
CID 121022748
N-(2-fluorophenyl)-3-hydroxypyrrolidine-1-carboxamide
CID 62917965
N-(2-fluorophenyl)-3-(2-hydroxyethyl)pyrrolidine-1-carboxamide
CID 113241349
3-(cyclopropylmethoxy)-N-pyridin-3-ylpyrrolidine-1-carboxamide
CID 119105538
N-(2-fluorophenyl)-3-pyridazin-3-yloxypyrrolidine-1-carboxamide
CID 90638455
methyl 1-[(2-fluorophenyl)carbamoyl]pyrrolidine-3-carboxylate
CID 47258210
N-(2-fluorophenyl)-3-(piperidin-1-ylmethyl)pyrrolidine-1-carboxamide
CID 146127859
(3R,4S)-N-(2-fluorophenyl)-3,4-dihydroxypyrrolidine-1-carboxamide
CID 79410579
[(3R)-3-(cyclopropylmethoxy)pyrrolidin-1-yl]-(3,4-difluorophenyl)methanone
CID 129358042

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide?
The IUPAC name of 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide (CID 121197683) is 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide?
The canonical SMILES for 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide is O=C(Nc1ccccc1F)N1CCC(OCC2CC2)C1.
What is the InChIKey of 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide?
The InChIKey is QKCHZMGJQNBIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c16-13-3-1-2-4-14(13)17-15(19)18-8-7-12(9-18)20-10-11-5-6-11/h1-4,11-12H,5-10H2,(H,17,19).
What are the key properties of 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide?
3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide has a molecular weight of 278.33 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethoxy)-N-(2-fluorophenyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 121197683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).