(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide

C18H22N2O2 — CID 96554428

IUPAC(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide
SMILESC[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-14(13-16-9-6-12-22-16)19-18(21)20-11-5-10-17(20)15-7-3-2-4-8-15/h2-4,6-9,12,14,17H,5,10-11,13H2,1H3,(H,19,21)/t14-,17-/m1/s1
InChIKeyCXEJEOCPRYVFGU-RHSMWYFYSA-N
MW298.39 g/mol
LogP3.76
Rot. Bonds4

About (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide

(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide (PubChem CID 96554428) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide
PubChem CID96554428
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC Name(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide
SMILESC[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-14(13-16-9-6-12-22-16)19-18(21)20-11-5-10-17(20)15-7-3-2-4-8-15/h2-4,6-9,12,14,17H,5,10-11,13H2,1H3,(H,19,21)/t14-,17-/m1/s1
InChIKeyCXEJEOCPRYVFGU-RHSMWYFYSA-N
XLogP3.76
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[1-(furan-2-yl)propan-2-ylcarbamoyl]thiomorpholine-3-carboxylic acid
CID 82904722
3-acetamido-N-[1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
CID 71893038
(3R)-3-acetamido-N-[(2S)-1-(furan-2-yl)propan-2-yl]piperidine-1-carboxamide
CID 97087871
N-[(2S)-1-(furan-2-yl)propan-2-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 35684027
2-[1-[1-(furan-2-yl)propan-2-ylcarbamoyl]azetidin-3-yl]propanoic acid
CID 116683044
(3R)-1-[4-(furan-2-yl)butan-2-ylcarbamoyl]piperidine-3-carboxylic acid
CID 81128264
(2S)-N-[(2S)-1-(2,6-difluorophenyl)propan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 94801401
N-[(2R)-1-(furan-2-yl)propan-2-yl]-4-(methanesulfonamido)piperidine-1-carboxamide
CID 95383461
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
(2R)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 94031024
2-(4-methoxyphenyl)-N-(1-thiophen-2-ylpropan-2-yl)azepane-1-carboxamide
CID 112837697
1-(1-phenylpropan-2-ylcarbamoyl)pyrrolidine-2-carboxylic acid
CID 63010608

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide?
The IUPAC name of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide (CID 96554428) is (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide is C[C@H](Cc1ccco1)NC(=O)N1CCC[C@@H]1c1ccccc1.
What is the InChIKey of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide?
The InChIKey is CXEJEOCPRYVFGU-RHSMWYFYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-14(13-16-9-6-12-22-16)19-18(21)20-11-5-10-17(20)15-7-3-2-4-8-15/h2-4,6-9,12,14,17H,5,10-11,13H2,1H3,(H,19,21)/t14-,17-/m1/s1.
What are the key properties of (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide?
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide has a molecular weight of 298.39 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-phenylpyrrolidine-1-carboxamide is sourced from PubChem (CID 96554428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).