(2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride

C15H25ClN2O — CID 120873867

IUPAC(2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride
SMILESCC(Cc1ccc(C(C)C)cc1)NC(=O)[C@@H](C)N.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-10(2)14-7-5-13(6-8-14)9-11(3)17-15(18)12(4)16;/h5-8,10-12H,9,16H2,1-4H3,(H,17,18);1H/t11?,12-;/m1./s1
InChIKeyYMWPHFBPUBDTNJ-ALGPSANZSA-N
MW284.83 g/mol
LogP2.63
Rot. Bonds5

About (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride

(2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride (PubChem CID 120873867) has the molecular formula C15H25ClN2O and a molecular weight of 284.83 g/mol. Its IUPAC name is (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride.

Molecular Properties

Compound Name(2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride
PubChem CID120873867
Molecular FormulaC15H25ClN2O
Molecular Weight284.83 g/mol
Exact Mass284.17
IUPAC Name(2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride
SMILESCC(Cc1ccc(C(C)C)cc1)NC(=O)[C@@H](C)N.Cl
InChIInChI=1S/C15H24N2O.ClH/c1-10(2)14-7-5-13(6-8-14)9-11(3)17-15(18)12(4)16;/h5-8,10-12H,9,16H2,1-4H3,(H,17,18);1H/t11?,12-;/m1./s1
InChIKeyYMWPHFBPUBDTNJ-ALGPSANZSA-N
XLogP2.63
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.83
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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(2R)-2-amino-N-(1-phenylpropan-2-yl)propanamide
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(2R)-2-amino-N-[1-(3,5-dimethylphenyl)propan-2-yl]propanamide
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4-[1-(4-propan-2-ylphenyl)propan-2-ylcarbamoyl]cyclohexane-1-carboxylic acid
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N-[1-(4-chlorophenyl)propan-2-yl]-2-methylpropanamide
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(2S)-2-amino-N-[3-(4-propan-2-ylphenyl)propyl]propanamide
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2-amino-3-(4-propan-2-ylphenyl)propanamide
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3-amino-4-methyl-5-(4-propan-2-ylphenyl)pentanoic acid
CID 53417419
(2S)-2-amino-N-[1-(4-fluorophenyl)propan-2-yl]-3-methylbutanamide
CID 63009308
(2R)-2-amino-N-[1-(4-fluorophenyl)propan-2-yl]-3-methylbutanamide
CID 79012581
N-[1-[4-[2-(4-propan-2-ylphenyl)ethynyl]phenyl]propan-2-yl]cyclopropanecarboxamide
CID 90429490

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride?
The IUPAC name of (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride (CID 120873867) is (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride.
What is the SMILES notation for (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride?
The canonical SMILES for (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride is CC(Cc1ccc(C(C)C)cc1)NC(=O)[C@@H](C)N.Cl.
What is the InChIKey of (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride?
The InChIKey is YMWPHFBPUBDTNJ-ALGPSANZSA-N. The full InChI is InChI=1S/C15H24N2O.ClH/c1-10(2)14-7-5-13(6-8-14)9-11(3)17-15(18)12(4)16;/h5-8,10-12H,9,16H2,1-4H3,(H,17,18);1H/t11?,12-;/m1./s1.
What are the key properties of (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride?
(2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride has a molecular weight of 284.83 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[1-(4-propan-2-ylphenyl)propan-2-yl]propanamide;hydrochloride is sourced from PubChem (CID 120873867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).