(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide

C14H16N2OS — CID 62058382

IUPAC(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide
SMILESCc1ccc(CNC(=O)[C@H](N)c2ccccc2)s1
InChIInChI=1S/C14H16N2OS/c1-10-7-8-12(18-10)9-16-14(17)13(15)11-5-3-2-4-6-11/h2-8,13H,9,15H2,1H3,(H,16,17)/t13-/m1/s1
InChIKeyPHDYCGPRLDQJPX-CYBMUJFWSA-N
MW260.36 g/mol
LogP2.37
Rot. Bonds4

About (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide

(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide (PubChem CID 62058382) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide
PubChem CID62058382
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide
SMILESCc1ccc(CNC(=O)[C@H](N)c2ccccc2)s1
InChIInChI=1S/C14H16N2OS/c1-10-7-8-12(18-10)9-16-14(17)13(15)11-5-3-2-4-6-11/h2-8,13H,9,15H2,1H3,(H,16,17)/t13-/m1/s1
InChIKeyPHDYCGPRLDQJPX-CYBMUJFWSA-N
XLogP2.37
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-[(5-bromothiophen-2-yl)methyl]-2-phenylacetamide
CID 93434478
2-amino-N-[(4,5-dimethylthiophen-2-yl)methyl]-2-phenylacetamide
CID 65241218
(2S)-2-amino-N-[(4,5-dimethylthiophen-2-yl)methyl]-2-phenylacetamide
CID 104898011
(2S)-2-amino-N-[(5-methylthiophen-2-yl)methyl]butanamide
CID 79022853
(2S)-2-amino-3,3-dimethyl-N-[(5-methylthiophen-2-yl)methyl]butanamide;hydrochloride
CID 119709408
1-[(1S)-2-hydroxy-1-phenylethyl]-3-[(5-methylthiophen-2-yl)methyl]urea
CID 75448635
(2R)-2-amino-N-[(5-methylfuran-2-yl)methyl]-2-phenylacetamide
CID 55081694
(2S)-2-amino-N-[(4-methylthiophen-3-yl)methyl]-2-phenylacetamide
CID 104898150
2-amino-N-ethyl-2-phenylacetamide
CID 22262703
6-amino-2-methyl-N-[(5-methylthiophen-2-yl)methyl]heptanamide
CID 65291508
2-amino-4-methoxy-N-[(5-methylthiophen-2-yl)methyl]butanamide
CID 62475607
(2S)-2-amino-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-phenylacetamide
CID 104897686

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide (CID 62058382) is (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide is Cc1ccc(CNC(=O)[C@H](N)c2ccccc2)s1.
What is the InChIKey of (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide?
The InChIKey is PHDYCGPRLDQJPX-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-10-7-8-12(18-10)9-16-14(17)13(15)11-5-3-2-4-6-11/h2-8,13H,9,15H2,1H3,(H,16,17)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide?
(2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide has a molecular weight of 260.36 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(5-methylthiophen-2-yl)methyl]-2-phenylacetamide is sourced from PubChem (CID 62058382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).