N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide

C10H15F3N2O — CID 116655125

IUPACN-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
SMILESO=C(N1CCCC1)N(CC(F)(F)F)C1CC1
InChIInChI=1S/C10H15F3N2O/c11-10(12,13)7-15(8-3-4-8)9(16)14-5-1-2-6-14/h8H,1-7H2
InChIKeyAKUUDOGZKJWNSG-UHFFFAOYSA-N
MW236.24 g/mol
LogP2.23
Rot. Bonds2

About N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide

N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide (PubChem CID 116655125) has the molecular formula C10H15F3N2O and a molecular weight of 236.24 g/mol. Its IUPAC name is N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
PubChem CID116655125
Molecular FormulaC10H15F3N2O
Molecular Weight236.24 g/mol
Exact Mass236.11
IUPAC NameN-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide
SMILESO=C(N1CCCC1)N(CC(F)(F)F)C1CC1
InChIInChI=1S/C10H15F3N2O/c11-10(12,13)7-15(8-3-4-8)9(16)14-5-1-2-6-14/h8H,1-7H2
InChIKeyAKUUDOGZKJWNSG-UHFFFAOYSA-N
XLogP2.23
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide?
The IUPAC name of N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide (CID 116655125) is N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide is O=C(N1CCCC1)N(CC(F)(F)F)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide?
The InChIKey is AKUUDOGZKJWNSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2O/c11-10(12,13)7-15(8-3-4-8)9(16)14-5-1-2-6-14/h8H,1-7H2.
What are the key properties of N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide?
N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide has a molecular weight of 236.24 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 116655125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).