2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride

C10H15ClN2O2 — CID 159728581

IUPAC2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride
SMILESCc1ccc(O)c(NC(=O)C(C)N)c1.Cl
InChIInChI=1S/C10H14N2O2.ClH/c1-6-3-4-9(13)8(5-6)12-10(14)7(2)11;/h3-5,7,13H,11H2,1-2H3,(H,12,14);1H
InChIKeyOJARGUDYMPFZQA-UHFFFAOYSA-N
MW230.70 g/mol
LogP1.41
Rot. Bonds2

About 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride

2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride (PubChem CID 159728581) has the molecular formula C10H15ClN2O2 and a molecular weight of 230.70 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride
PubChem CID159728581
Molecular FormulaC10H15ClN2O2
Molecular Weight230.70 g/mol
Exact Mass230.08
IUPAC Name2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride
SMILESCc1ccc(O)c(NC(=O)C(C)N)c1.Cl
InChIInChI=1S/C10H14N2O2.ClH/c1-6-3-4-9(13)8(5-6)12-10(14)7(2)11;/h3-5,7,13H,11H2,1-2H3,(H,12,14);1H
InChIKeyOJARGUDYMPFZQA-UHFFFAOYSA-N
XLogP1.41
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.70
LogP ≤ 51.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-amino-N-(2-hydroxy-4-methylphenyl)propanamide
CID 127013339
2-amino-N-(2-chloro-5-methylphenyl)propanamide;hydrochloride
CID 119279638
(2R)-2-amino-N-(2-bromo-5-methylphenyl)propanamide
CID 82757390
(2R)-2-amino-N-(2-chloro-4-methylphenyl)propanamide;hydrochloride
CID 119262651
(2S)-2-amino-N-(2-methoxy-5-methylphenyl)propanamide
CID 22690513
(2S)-2-amino-N-[2-hydroxy-5-(trifluoromethyl)phenyl]propanamide
CID 81196961
N,N'-bis(2-hydroxy-5-methylphenyl)-2-methylpentanediamide
CID 20778624
N-(2-hydroxy-5-methylphenyl)-N'-propan-2-yloxamide
CID 108503273
methyl 2-[[(2R)-2-aminopropanoyl]amino]-5-methylbenzoate
CID 54991021
(2S)-2-amino-N-(4-hydroxynaphthalen-1-yl)propanamide;hydrochloride
CID 46179715
(E)-4-(2-hydroxy-5-methylanilino)pent-3-en-2-one
CID 177457771
2-amino-N-(2-methylphenyl)propanamide;hydrochloride
CID 56832187

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride?
The IUPAC name of 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride (CID 159728581) is 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride is Cc1ccc(O)c(NC(=O)C(C)N)c1.Cl.
What is the InChIKey of 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride?
The InChIKey is OJARGUDYMPFZQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2.ClH/c1-6-3-4-9(13)8(5-6)12-10(14)7(2)11;/h3-5,7,13H,11H2,1-2H3,(H,12,14);1H.
What are the key properties of 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride?
2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride has a molecular weight of 230.70 g/mol, XLogP of 1.41, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxy-5-methylphenyl)propanamide;hydrochloride is sourced from PubChem (CID 159728581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).