1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide

C15H19N3O2 — CID 155250067

IUPAC1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide
SMILESNC(=O)C1CN([C@H]2C[C@@H]2c2ccccc2)CC1C(N)=O
InChIInChI=1S/C15H19N3O2/c16-14(19)11-7-18(8-12(11)15(17)20)13-6-10(13)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2,(H2,16,19)(H2,17,20)/t10-,11?,12?,13+/m1/s1
InChIKeyFFZAYTQEVJYNOG-XVSSEFHLSA-N
MW273.34 g/mol
LogP0.06
Rot. Bonds4

About 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide

1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide (PubChem CID 155250067) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide.

Molecular Properties

Compound Name1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide
PubChem CID155250067
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide
SMILESNC(=O)C1CN([C@H]2C[C@@H]2c2ccccc2)CC1C(N)=O
InChIInChI=1S/C15H19N3O2/c16-14(19)11-7-18(8-12(11)15(17)20)13-6-10(13)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2,(H2,16,19)(H2,17,20)/t10-,11?,12?,13+/m1/s1
InChIKeyFFZAYTQEVJYNOG-XVSSEFHLSA-N
XLogP0.06
TPSA89.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1S,2R)-2-(4-fluorophenyl)cyclopropyl]pyrrolidine-3,4-dicarboxamide;hydrochloride
CID 175158537
2-phenylcyclobutane-1-carboxamide
CID 132565333
(3S,4R)-1-benzyl-4-phenylpyrrolidine-3-carboxamide
CID 91662836
cis-(1R,2S)-2-phenylcyclopropane-1-carboxylic acid
CID 778516
2-[(4R)-3-methyl-2-oxo-4-phenylpyrrolidin-1-yl]acetamide
CID 24744224
methyl (7S,8R,8aS)-7-carbamoyl-8-phenyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carboxylate
CID 134786967
ethane;2-phenylcyclopropane-1-carboxylic acid
CID 91570346
2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]propanamide
CID 114263437
(4R)-4-amino-1-[(1R,2S)-2-phenylcyclopropyl]pyrrolidin-2-one
CID 94003407
3-amino-2-methyl-1-(2-phenylcyclopropyl)propan-1-one
CID 116564403
2-(2-phenylcyclopropyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929782
4-phenyl-1-[(1R,2S)-2-phenylcyclopropyl]piperidin-4-ol;hydrochloride
CID 3064357

Frequently Asked Questions

What is the IUPAC name of 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide?
The IUPAC name of 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide (CID 155250067) is 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide.
What is the SMILES notation for 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide?
The canonical SMILES for 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide is NC(=O)C1CN([C@H]2C[C@@H]2c2ccccc2)CC1C(N)=O.
What is the InChIKey of 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide?
The InChIKey is FFZAYTQEVJYNOG-XVSSEFHLSA-N. The full InChI is InChI=1S/C15H19N3O2/c16-14(19)11-7-18(8-12(11)15(17)20)13-6-10(13)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2,(H2,16,19)(H2,17,20)/t10-,11?,12?,13+/m1/s1.
What are the key properties of 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide?
1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide has a molecular weight of 273.34 g/mol, XLogP of 0.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S,2R)-2-phenylcyclopropyl]pyrrolidine-3,4-dicarboxamide is sourced from PubChem (CID 155250067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).