2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride

C14H23ClN2O — CID 120586686

IUPAC2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride
SMILESCC(C)C(C)NC(=O)C(C)(N)c1ccccc1.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-10(2)11(3)16-13(17)14(4,15)12-8-6-5-7-9-12;/h5-11H,15H2,1-4H3,(H,16,17);1H
InChIKeyQHJMNLJENMTCGN-UHFFFAOYSA-N
MW270.80 g/mol
LogP2.44
Rot. Bonds4

About 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride

2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride (PubChem CID 120586686) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride
PubChem CID120586686
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC Name2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride
SMILESCC(C)C(C)NC(=O)C(C)(N)c1ccccc1.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-10(2)11(3)16-13(17)14(4,15)12-8-6-5-7-9-12;/h5-11H,15H2,1-4H3,(H,16,17);1H
InChIKeyQHJMNLJENMTCGN-UHFFFAOYSA-N
XLogP2.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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2-amino-N-hexan-2-yl-2-phenylpropanamide
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2-amino-N-[1-(2-methylphenyl)ethyl]-2-phenylpropanamide;hydrochloride
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CID 55078586
2-amino-2-phenyl-N-(1-phenylpropan-2-yl)propanamide
CID 63011622
(2R)-2-[(2-amino-2-phenylpropanoyl)amino]-4-methylpentanoic acid
CID 78991000
2-amino-N-(1-cyanopropan-2-yl)-2-phenylpropanamide
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride (CID 120586686) is 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride is CC(C)C(C)NC(=O)C(C)(N)c1ccccc1.Cl.
What is the InChIKey of 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride?
The InChIKey is QHJMNLJENMTCGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.ClH/c1-10(2)11(3)16-13(17)14(4,15)12-8-6-5-7-9-12;/h5-11H,15H2,1-4H3,(H,16,17);1H.
What are the key properties of 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride?
2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride has a molecular weight of 270.80 g/mol, XLogP of 2.44, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methylbutan-2-yl)-2-phenylpropanamide;hydrochloride is sourced from PubChem (CID 120586686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).