N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide

C14H20N2O2 — CID 114010293

IUPACN-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C14H20N2O2/c17-10-13(11-5-2-1-3-6-11)16-14(18)9-12-7-4-8-15-12/h1-3,5-6,12-13,15,17H,4,7-10H2,(H,16,18)/t12?,13-/m0/s1
InChIKeyRCYPNDONZFCODO-ABLWVSNPSA-N
MW248.33 g/mol
LogP0.98
Rot. Bonds5

About N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide

N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide (PubChem CID 114010293) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide.

Molecular Properties

Compound NameN-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide
PubChem CID114010293
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide
SMILESO=C(CC1CCCN1)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C14H20N2O2/c17-10-13(11-5-2-1-3-6-11)16-14(18)9-12-7-4-8-15-12/h1-3,5-6,12-13,15,17H,4,7-10H2,(H,16,18)/t12?,13-/m0/s1
InChIKeyRCYPNDONZFCODO-ABLWVSNPSA-N
XLogP0.98
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenoxy-1-phenylethyl)-2-pyrrolidin-2-ylacetamide
CID 119779882
(2S)-2-phenyl-2-(pyrrolidin-2-ylmethylamino)ethanol
CID 107862197
N-[(1R)-2-hydroxy-1-phenylethyl]pyrrolidine-2-carboxamide
CID 107863240
methyl 2-phenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]acetate;hydrochloride
CID 119707961
2-phenyl-2-(1-pyrrolidin-2-ylpropan-2-ylamino)ethanol
CID 79539961
N-[1-(4-phenylphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119685566
methyl 2-methyl-3-phenyl-3-[(2-pyrrolidin-2-ylacetyl)amino]propanoate
CID 119818568
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
CID 107863325
N-[2-(dimethylamino)-2-phenylethyl]-2-pyrrolidin-2-ylacetamide
CID 61365271
N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2-pyrrolidin-2-ylacetamide
CID 119859537
N-(2,3-diphenylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119803974
N-(1-phenylpropyl)-3-piperidin-2-ylpropanamide
CID 62305915

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide?
The IUPAC name of N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide (CID 114010293) is N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide.
What is the SMILES notation for N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide?
The canonical SMILES for N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide is O=C(CC1CCCN1)N[C@@H](CO)c1ccccc1.
What is the InChIKey of N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide?
The InChIKey is RCYPNDONZFCODO-ABLWVSNPSA-N. The full InChI is InChI=1S/C14H20N2O2/c17-10-13(11-5-2-1-3-6-11)16-14(18)9-12-7-4-8-15-12/h1-3,5-6,12-13,15,17H,4,7-10H2,(H,16,18)/t12?,13-/m0/s1.
What are the key properties of N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide?
N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide has a molecular weight of 248.33 g/mol, XLogP of 0.98, 5 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]-2-pyrrolidin-2-ylacetamide is sourced from PubChem (CID 114010293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).