(2R)-2-amino-N-(4-hydroxyphenyl)propanamide

C9H12N2O2 — CID 78972563

IUPAC(2R)-2-amino-N-(4-hydroxyphenyl)propanamide
SMILESC[C@@H](N)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C9H12N2O2/c1-6(10)9(13)11-7-2-4-8(12)5-3-7/h2-6,12H,10H2,1H3,(H,11,13)/t6-/m1/s1
InChIKeyVKFBFGWCYFWFQT-ZCFIWIBFSA-N
MW180.21 g/mol
LogP0.68
Rot. Bonds2

About (2R)-2-amino-N-(4-hydroxyphenyl)propanamide

(2R)-2-amino-N-(4-hydroxyphenyl)propanamide (PubChem CID 78972563) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is (2R)-2-amino-N-(4-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(4-hydroxyphenyl)propanamide
PubChem CID78972563
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name(2R)-2-amino-N-(4-hydroxyphenyl)propanamide
SMILESC[C@@H](N)C(=O)Nc1ccc(O)cc1
InChIInChI=1S/C9H12N2O2/c1-6(10)9(13)11-7-2-4-8(12)5-3-7/h2-6,12H,10H2,1H3,(H,11,13)/t6-/m1/s1
InChIKeyVKFBFGWCYFWFQT-ZCFIWIBFSA-N
XLogP0.68
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-(4-acetamidophenyl)-2-aminopropanamide;hydrochloride
CID 119261426
(2R)-2-amino-N-(4-chlorophenyl)propanamide
CID 7183165
(2R)-2-amino-N-phenylpropanamide
CID 10607114
2-amino-N-(4-fluorophenyl)propanamide;hydrochloride
CID 56832255
2-amino-N-(4-hydroxyphenyl)-4-methylpentanamide
CID 22768242
(2S)-2-amino-N-[4-(hydroxymethyl)phenyl]propanamide
CID 103691721
(2R)-2-amino-N-pyridin-4-ylpropanamide
CID 78972247
2-amino-N-(4-methylsulfanylphenyl)propanamide;hydrochloride
CID 119273773
(2R)-2-amino-N-[4-(propanoylamino)phenyl]propanamide;hydrochloride
CID 119296177
4-[[(2R)-2-aminopropanoyl]amino]-N-methylbenzamide
CID 78972443
(2S)-2-amino-N-(4-methylsulfanylphenyl)propanamide;hydrochloride
CID 119273769
2-amino-N-(4-pyridin-4-ylphenyl)propanamide
CID 110460098

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(4-hydroxyphenyl)propanamide?
The IUPAC name of (2R)-2-amino-N-(4-hydroxyphenyl)propanamide (CID 78972563) is (2R)-2-amino-N-(4-hydroxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(4-hydroxyphenyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(4-hydroxyphenyl)propanamide is C[C@@H](N)C(=O)Nc1ccc(O)cc1.
What is the InChIKey of (2R)-2-amino-N-(4-hydroxyphenyl)propanamide?
The InChIKey is VKFBFGWCYFWFQT-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-6(10)9(13)11-7-2-4-8(12)5-3-7/h2-6,12H,10H2,1H3,(H,11,13)/t6-/m1/s1.
What are the key properties of (2R)-2-amino-N-(4-hydroxyphenyl)propanamide?
(2R)-2-amino-N-(4-hydroxyphenyl)propanamide has a molecular weight of 180.21 g/mol, XLogP of 0.68, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(4-hydroxyphenyl)propanamide is sourced from PubChem (CID 78972563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).