2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride

C18H23ClN2O2 — CID 119306292

IUPAC2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride
SMILESCC(C)OCc1cccc(NC(=O)C(N)c2ccccc2)c1.Cl
InChIInChI=1S/C18H22N2O2.ClH/c1-13(2)22-12-14-7-6-10-16(11-14)20-18(21)17(19)15-8-4-3-5-9-15;/h3-11,13,17H,12,19H2,1-2H3,(H,20,21);1H
InChIKeyIGUCSGFJYKKUQK-UHFFFAOYSA-N
MW334.85 g/mol
LogP3.67
Rot. Bonds6

About 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride

2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride (PubChem CID 119306292) has the molecular formula C18H23ClN2O2 and a molecular weight of 334.85 g/mol. Its IUPAC name is 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride
PubChem CID119306292
Molecular FormulaC18H23ClN2O2
Molecular Weight334.85 g/mol
Exact Mass334.14
IUPAC Name2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride
SMILESCC(C)OCc1cccc(NC(=O)C(N)c2ccccc2)c1.Cl
InChIInChI=1S/C18H22N2O2.ClH/c1-13(2)22-12-14-7-6-10-16(11-14)20-18(21)17(19)15-8-4-3-5-9-15;/h3-11,13,17H,12,19H2,1-2H3,(H,20,21);1H
InChIKeyIGUCSGFJYKKUQK-UHFFFAOYSA-N
XLogP3.67
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.85
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 119306295
2-amino-3-methoxy-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 120987551
2-amino-3-methyl-N-[3-(propan-2-yloxymethyl)phenyl]pentanamide
CID 119753959
(2S)-2-amino-4-methylsulfanyl-N-[3-(propan-2-yloxymethyl)phenyl]butanamide
CID 119306285
3-amino-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 119306277
3-(2-aminophenyl)-N-[3-(propan-2-yloxymethyl)phenyl]propanamide;hydrochloride
CID 120609902
3-amino-N-naphthalen-2-yl-2-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 157147686
N-[3-(ethoxymethyl)phenyl]-2-hydroxy-2-phenylacetamide
CID 111432650
1-amino-N-[3-(propan-2-yloxymethyl)phenyl]cyclopentane-1-carboxamide;hydrochloride
CID 119306290
(2S)-2-amino-3-(1-benzylimidazol-4-yl)-N-[3-(propan-2-yloxymethyl)phenyl]propanamide
CID 119753971
3-amino-N-(3-ethylphenyl)-2-methyl-3-phenylpropanamide
CID 80546422
3-[[(2S)-2-amino-2-phenylacetyl]amino]benzoic acid
CID 103868733

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride?
The IUPAC name of 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride (CID 119306292) is 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride.
What is the SMILES notation for 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride?
The canonical SMILES for 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride is CC(C)OCc1cccc(NC(=O)C(N)c2ccccc2)c1.Cl.
What is the InChIKey of 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride?
The InChIKey is IGUCSGFJYKKUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2.ClH/c1-13(2)22-12-14-7-6-10-16(11-14)20-18(21)17(19)15-8-4-3-5-9-15;/h3-11,13,17H,12,19H2,1-2H3,(H,20,21);1H.
What are the key properties of 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride?
2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride has a molecular weight of 334.85 g/mol, XLogP of 3.67, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-phenyl-N-[3-(propan-2-yloxymethyl)phenyl]acetamide;hydrochloride is sourced from PubChem (CID 119306292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).