(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide

C15H18F2N2O — CID 103795055

IUPAC(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide
SMILESO=C([C@H]1CCCN1)N(Cc1ccc(F)cc1F)C1CC1
InChIInChI=1S/C15H18F2N2O/c16-11-4-3-10(13(17)8-11)9-19(12-5-6-12)15(20)14-2-1-7-18-14/h3-4,8,12,14,18H,1-2,5-7,9H2/t14-/m1/s1
InChIKeyQQWFQMPBJMSJSP-CQSZACIVSA-N
MW280.32 g/mol
LogP2.21
Rot. Bonds4

About (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide

(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 103795055) has the molecular formula C15H18F2N2O and a molecular weight of 280.32 g/mol. Its IUPAC name is (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide
PubChem CID103795055
Molecular FormulaC15H18F2N2O
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide
SMILESO=C([C@H]1CCCN1)N(Cc1ccc(F)cc1F)C1CC1
InChIInChI=1S/C15H18F2N2O/c16-11-4-3-10(13(17)8-11)9-19(12-5-6-12)15(20)14-2-1-7-18-14/h3-4,8,12,14,18H,1-2,5-7,9H2/t14-/m1/s1
InChIKeyQQWFQMPBJMSJSP-CQSZACIVSA-N
XLogP2.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]piperidine-2-carboxamide
CID 104913311
N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide
CID 60737551
2-bromo-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]acetamide
CID 63679516
(2R)-N-[(4-chlorophenyl)methyl]-N-cyclopropylpiperidine-2-carboxamide
CID 104913309
N-benzyl-N-cyclopropylpiperidine-2-carboxamide
CID 43579225
1-(aminomethyl)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]cyclobutane-1-carboxamide
CID 115448025
N-cyclopropyl-N-(pyridin-4-ylmethyl)azepane-2-carboxamide
CID 64562460
tert-butyl N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]carbamate
CID 63789029
N-[(2-fluorophenyl)methyl]-N-methylpyrrolidine-2-carboxamide
CID 42890905
(2S)-2-amino-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]propanamide;hydrochloride
CID 119284890
N-cyclopropyl-N-(thiophen-2-ylmethyl)pyrrolidine-2-carboxamide
CID 54870571
3-amino-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]butanamide
CID 54870409

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide (CID 103795055) is (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide is O=C([C@H]1CCCN1)N(Cc1ccc(F)cc1F)C1CC1.
What is the InChIKey of (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is QQWFQMPBJMSJSP-CQSZACIVSA-N. The full InChI is InChI=1S/C15H18F2N2O/c16-11-4-3-10(13(17)8-11)9-19(12-5-6-12)15(20)14-2-1-7-18-14/h3-4,8,12,14,18H,1-2,5-7,9H2/t14-/m1/s1.
What are the key properties of (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide?
(2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 280.32 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclopropyl-N-[(2,4-difluorophenyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 103795055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).