(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide

C15H19NO2 — CID 129445975

IUPAC(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide
SMILESO=C(N[C@@H]1C[C@H]2CC[C@H]1C2)[C@H](O)c1ccccc1
InChIInChI=1S/C15H19NO2/c17-14(11-4-2-1-3-5-11)15(18)16-13-9-10-6-7-12(13)8-10/h1-5,10,12-14,17H,6-9H2,(H,16,18)/t10-,12-,13+,14+/m0/s1
InChIKeyGXYMBIRBWRFAIC-SCUASFONSA-N
MW245.32 g/mol
LogP2.02
Rot. Bonds3

About (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide

(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide (PubChem CID 129445975) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide
PubChem CID129445975
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide
SMILESO=C(N[C@@H]1C[C@H]2CC[C@H]1C2)[C@H](O)c1ccccc1
InChIInChI=1S/C15H19NO2/c17-14(11-4-2-1-3-5-11)15(18)16-13-9-10-6-7-12(13)8-10/h1-5,10,12-14,17H,6-9H2,(H,16,18)/t10-,12-,13+,14+/m0/s1
InChIKeyGXYMBIRBWRFAIC-SCUASFONSA-N
XLogP2.02
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide with MolForge

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Related Compounds

(2S)-2-amino-N-(2-bicyclo[2.2.1]heptanyl)-3-phenylpropanamide
CID 78995761
(2S)-N-[(1S,2S,4R)-2-bicyclo[2.2.1]heptanyl]-2-phenylsulfanylpropanamide
CID 881755
N-[(1S,2S,4R)-2-bicyclo[2.2.1]heptanyl]benzamide
CID 1338021
N-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]benzamide
CID 6980977
1-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-3-phenylurea
CID 11892921
N-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-phenylsulfanylacetamide
CID 18555874
(2S)-N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-2-(2-methylphenoxy)propanamide
CID 100581699
2-(2-bicyclo[2.2.1]heptanylamino)-2-phenylethanol
CID 63182183
N-(2-aminocyclohexyl)-2-hydroxy-2-phenylacetamide
CID 54905053
N-(2-bicyclo[2.2.1]heptanyl)-3-phenylsulfanylpropanamide
CID 2899831
N-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-(2-chlorophenyl)acetamide
CID 100631226
N-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-methylbenzamide
CID 958830

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide?
The IUPAC name of (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide (CID 129445975) is (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide.
What is the SMILES notation for (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide?
The canonical SMILES for (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide is O=C(N[C@@H]1C[C@H]2CC[C@H]1C2)[C@H](O)c1ccccc1.
What is the InChIKey of (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide?
The InChIKey is GXYMBIRBWRFAIC-SCUASFONSA-N. The full InChI is InChI=1S/C15H19NO2/c17-14(11-4-2-1-3-5-11)15(18)16-13-9-10-6-7-12(13)8-10/h1-5,10,12-14,17H,6-9H2,(H,16,18)/t10-,12-,13+,14+/m0/s1.
What are the key properties of (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide?
(2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide has a molecular weight of 245.32 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]-2-hydroxy-2-phenylacetamide is sourced from PubChem (CID 129445975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).