N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide

C16H20N2O2 — CID 47164597

IUPACN-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CC1)C1CCCN1C(=O)Cc1ccccc1
InChIInChI=1S/C16H20N2O2/c19-15(11-12-5-2-1-3-6-12)18-10-4-7-14(18)16(20)17-13-8-9-13/h1-3,5-6,13-14H,4,7-11H2,(H,17,20)
InChIKeyVDYAXPUDFFPJAM-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.50
Rot. Bonds4

About N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide

N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide (PubChem CID 47164597) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
PubChem CID47164597
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CC1)C1CCCN1C(=O)Cc1ccccc1
InChIInChI=1S/C16H20N2O2/c19-15(11-12-5-2-1-3-6-12)18-10-4-7-14(18)16(20)17-13-8-9-13/h1-3,5-6,13-14H,4,7-11H2,(H,17,20)
InChIKeyVDYAXPUDFFPJAM-UHFFFAOYSA-N
XLogP1.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-cycloheptyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 95190248
N-(1-cyclopropylpiperidin-4-yl)-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 47881551
methyl 4-[[1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]piperidine-1-carboxylate
CID 47897958
N-cyclopropyl-1-[2-(1H-indol-3-yl)acetyl]pyrrolidine-2-carboxamide
CID 86924365
(2R)-N-(4-benzamidocyclohexyl)-1-(3-phenylpropanoyl)pyrrolidine-2-carboxamide
CID 46105589
(2S)-N-(4-benzamidocyclohexyl)-1-(3-phenylpropanoyl)pyrrolidine-2-carboxamide
CID 51071444
(2S)-N-oxo-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 89035815
N-(2-hydroxyphenyl)-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 47923867
(2S)-N-(2-hydroxyphenyl)-1-(2-phenylacetyl)pyrrolidine-2-carboxamide
CID 95216209
N-cyclopropyl-1-[2-(2-nitrophenyl)acetyl]pyrrolidine-2-carboxamide
CID 86924380
(2R)-1-(2-phenylacetyl)-N-[4-[(E)-2-[4-[[(2R)-1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]phenyl]ethenyl]phenyl]pyrrolidine-2-carboxamide
CID 53326825
4-[[[1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]methyl]benzoic acid
CID 119353518

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide (CID 47164597) is N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide is O=C(NC1CC1)C1CCCN1C(=O)Cc1ccccc1.
What is the InChIKey of N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide?
The InChIKey is VDYAXPUDFFPJAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c19-15(11-12-5-2-1-3-6-12)18-10-4-7-14(18)16(20)17-13-8-9-13/h1-3,5-6,13-14H,4,7-11H2,(H,17,20).
What are the key properties of N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide?
N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(2-phenylacetyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 47164597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).