N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide

C13H18N2O2 — CID 107863240

IUPACN-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide
SMILESO=C(N[C@@H](CO)c1ccccc1)C1CCCN1
InChIInChI=1S/C13H18N2O2/c16-9-12(10-5-2-1-3-6-10)15-13(17)11-7-4-8-14-11/h1-3,5-6,11-12,14,16H,4,7-9H2,(H,15,17)/t11?,12-/m0/s1
InChIKeyIYKRYWSZNBOMAM-KIYNQFGBSA-N
MW234.30 g/mol
LogP0.59
Rot. Bonds4

About N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide

N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide (PubChem CID 107863240) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide
PubChem CID107863240
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide
SMILESO=C(N[C@@H](CO)c1ccccc1)C1CCCN1
InChIInChI=1S/C13H18N2O2/c16-9-12(10-5-2-1-3-6-10)15-13(17)11-7-4-8-14-11/h1-3,5-6,11-12,14,16H,4,7-9H2,(H,15,17)/t11?,12-/m0/s1
InChIKeyIYKRYWSZNBOMAM-KIYNQFGBSA-N
XLogP0.59
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-benzhydrylpyrrolidine-2-carboxamide
CID 10663256
(2R)-N-(1-phenylbutyl)piperidine-2-carboxamide
CID 104913042
(2S)-N-(1-phenylbutyl)piperidine-2-carboxamide
CID 104913043
(2S)-N-[(S)-hydroxy(phenyl)methyl]pyrrolidine-2-carboxamide
CID 101392822
N-[(1R)-2-hydroxy-1-phenylethyl]-1,3-thiazolidine-4-carboxamide
CID 107863284
N-[(1S)-2-hydroxy-1-phenylethyl]morpholine-3-carboxamide
CID 107862923
N-(1-phenylethyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261657
(3S)-3-phenyl-3-[[(2S,3R,4R,5S)-2,3,4,6-tetrahydroxy-5-[[(2S)-pyrrolidine-2-carbonyl]amino]hexanoyl]amino]propanoic acid
CID 11080670
N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide
CID 114010293
N-(2-hydroxy-1-phenylethyl)cyclobutanecarboxamide
CID 63184812
N-[(1S)-2-hydroxy-1-phenylethyl]cyclobutanecarboxamide
CID 103945021
N-[(1R)-2-hydroxy-1-phenylethyl]piperidine-4-carboxamide
CID 103951345

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide (CID 107863240) is N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide is O=C(N[C@@H](CO)c1ccccc1)C1CCCN1.
What is the InChIKey of N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide?
The InChIKey is IYKRYWSZNBOMAM-KIYNQFGBSA-N. The full InChI is InChI=1S/C13H18N2O2/c16-9-12(10-5-2-1-3-6-10)15-13(17)11-7-4-8-14-11/h1-3,5-6,11-12,14,16H,4,7-9H2,(H,15,17)/t11?,12-/m0/s1.
What are the key properties of N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide?
N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 0.59, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 107863240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).