(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide

C14H20N2O3 — CID 81130040

IUPAC(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
SMILESN[C@@H](C(=O)NCC1(O)CCOCC1)c1ccccc1
InChIInChI=1S/C14H20N2O3/c15-12(11-4-2-1-3-5-11)13(17)16-10-14(18)6-8-19-9-7-14/h1-5,12,18H,6-10,15H2,(H,16,17)/t12-/m1/s1
InChIKeyBSNRMUZKNPOWDX-GFCCVEGCSA-N
MW264.32 g/mol
LogP0.34
Rot. Bonds4

About (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide

(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide (PubChem CID 81130040) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
PubChem CID81130040
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
SMILESN[C@@H](C(=O)NCC1(O)CCOCC1)c1ccccc1
InChIInChI=1S/C14H20N2O3/c15-12(11-4-2-1-3-5-11)13(17)16-10-14(18)6-8-19-9-7-14/h1-5,12,18H,6-10,15H2,(H,16,17)/t12-/m1/s1
InChIKeyBSNRMUZKNPOWDX-GFCCVEGCSA-N
XLogP0.34
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-N-[(1-hydroxy-4,4-dimethylcyclohexyl)methyl]-2-phenylacetamide
CID 65120039
2-amino-N-[(4-methylsulfanyloxan-4-yl)methyl]-2-phenylacetamide;hydrochloride
CID 119336127
(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylpropanamide
CID 81130811
2-amino-N-[(3-hydroxyoxolan-3-yl)methyl]-2-(4-methylphenyl)acetamide
CID 106312973
2-amino-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]-2-phenylacetamide
CID 65119962
1-[(4-hydroxyoxan-4-yl)methyl]-3-(2-methyl-1-phenylpropyl)urea
CID 110936500
1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 115433544
N-[(4-hydroxyoxan-4-yl)methyl]-3-phenylprop-2-ynamide
CID 79488152
1-[cyclopropyl(phenyl)methyl]-3-[(4-hydroxyoxan-4-yl)methyl]urea
CID 110936515
N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide
CID 79038917
2-amino-2-phenyl-N-[(1-propan-2-ylcyclopropyl)methyl]acetamide;hydrochloride
CID 119333913
1-[[[(2R)-2-amino-2-phenylacetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 115436319

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide (CID 81130040) is (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide is N[C@@H](C(=O)NCC1(O)CCOCC1)c1ccccc1.
What is the InChIKey of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide?
The InChIKey is BSNRMUZKNPOWDX-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H20N2O3/c15-12(11-4-2-1-3-5-11)13(17)16-10-14(18)6-8-19-9-7-14/h1-5,12,18H,6-10,15H2,(H,16,17)/t12-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide?
(2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide has a molecular weight of 264.32 g/mol, XLogP of 0.34, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(4-hydroxyoxan-4-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 81130040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).