(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide

C12H18N2O2 — CID 119293211

IUPAC(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide
SMILESCc1ccc(C(O)CNC(=O)[C@@H](C)N)cc1
InChIInChI=1S/C12H18N2O2/c1-8-3-5-10(6-4-8)11(15)7-14-12(16)9(2)13/h3-6,9,11,15H,7,13H2,1-2H3,(H,14,16)/t9-,11?/m1/s1
InChIKeyKDEPDRFBJXEWKJ-BFHBGLAWSA-N
MW222.29 g/mol
LogP0.49
Rot. Bonds4

About (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide

(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide (PubChem CID 119293211) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide
PubChem CID119293211
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide
SMILESCc1ccc(C(O)CNC(=O)[C@@H](C)N)cc1
InChIInChI=1S/C12H18N2O2/c1-8-3-5-10(6-4-8)11(15)7-14-12(16)9(2)13/h3-6,9,11,15H,7,13H2,1-2H3,(H,14,16)/t9-,11?/m1/s1
InChIKeyKDEPDRFBJXEWKJ-BFHBGLAWSA-N
XLogP0.49
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]propanamide;hydrochloride
CID 119328695
2-amino-N-(2-hydroxy-3-methylbutyl)-2-(4-methylphenyl)acetamide
CID 114172133
(2S)-2-amino-N-[2-(3-fluorophenyl)-2-hydroxyethyl]propanamide
CID 119306982
2-amino-2-(4-methylphenyl)-N-[2-(4-methylphenyl)propyl]acetamide
CID 120668682
N-(2-hydroxypropyl)-2-(4-methylphenyl)propanamide
CID 144745101
2-N,5-N-bis[2-hydroxy-2-(4-methylphenyl)ethyl]thiophene-2,5-dicarboxamide
CID 112827264
N-[2-hydroxy-2-(4-propan-2-yloxyphenyl)ethyl]-2-methyl-3-(4-methylphenyl)propanamide
CID 139000342
(2S)-2-amino-N-[1-(4-methylphenyl)ethyl]propanamide
CID 61147129
(2R)-2-amino-N-[2-(4-methylphenyl)ethyl]propanamide;hydrochloride
CID 119326879
(2S)-2-amino-N-[2-(4-methylphenyl)ethyl]propanamide;hydrochloride
CID 119326870
N-[2-(4-chlorophenyl)-2-hydroxyethyl]-2-methylpropanamide
CID 82117612
2-amino-N-[1-(4-methylphenyl)propyl]propanamide
CID 43707472

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide (CID 119293211) is (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide is Cc1ccc(C(O)CNC(=O)[C@@H](C)N)cc1.
What is the InChIKey of (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide?
The InChIKey is KDEPDRFBJXEWKJ-BFHBGLAWSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8-3-5-10(6-4-8)11(15)7-14-12(16)9(2)13/h3-6,9,11,15H,7,13H2,1-2H3,(H,14,16)/t9-,11?/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide?
(2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide has a molecular weight of 222.29 g/mol, XLogP of 0.49, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-hydroxy-2-(4-methylphenyl)ethyl]propanamide is sourced from PubChem (CID 119293211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).