2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride

C16H25ClN2O2 — CID 120669141

IUPAC2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride
SMILESCOC1CC(NC(=O)C(N)c2ccc(C)cc2)C1(C)C.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-10-5-7-11(8-6-10)14(17)15(19)18-12-9-13(20-4)16(12,2)3;/h5-8,12-14H,9,17H2,1-4H3,(H,18,19);1H
InChIKeyLAGNAZVAYHEHGK-UHFFFAOYSA-N
MW312.84 g/mol
LogP2.35
Rot. Bonds4

About 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride

2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride (PubChem CID 120669141) has the molecular formula C16H25ClN2O2 and a molecular weight of 312.84 g/mol. Its IUPAC name is 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride
PubChem CID120669141
Molecular FormulaC16H25ClN2O2
Molecular Weight312.84 g/mol
Exact Mass312.16
IUPAC Name2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride
SMILESCOC1CC(NC(=O)C(N)c2ccc(C)cc2)C1(C)C.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-10-5-7-11(8-6-10)14(17)15(19)18-12-9-13(20-4)16(12,2)3;/h5-8,12-14H,9,17H2,1-4H3,(H,18,19);1H
InChIKeyLAGNAZVAYHEHGK-UHFFFAOYSA-N
XLogP2.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.84
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4,4-dimethylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668551
(2S)-2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-3-phenylpropanamide;hydrochloride
CID 119343152
2-amino-N-(4-methylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668364
2-amino-N-(3-methylcyclohexyl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120667211
3-[[2-amino-2-(4-methylphenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 103869698
2-(4-aminophenyl)-N-(3-methoxy-2,2-dimethylcyclobutyl)acetamide
CID 103812779
2-amino-N-[(1-methylcyclopropyl)methyl]-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668819
2-amino-N-(1-cyclopropylpiperidin-4-yl)-2-(4-methylphenyl)acetamide;dihydrochloride
CID 120669508
2-amino-2-(4-methylphenyl)-N-(4-methylsulfanylcyclohexyl)acetamide
CID 106312954
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)-2-(4-methylphenyl)acetamide;dihydrochloride
CID 120669933
2-amino-N-(1-cyclopropylpiperidin-4-yl)-2-(4-methylphenyl)acetamide
CID 106151639
2-amino-N-(2-aminoethyl)-2-(4-methylphenyl)acetamide
CID 106151018

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride?
The IUPAC name of 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride (CID 120669141) is 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride.
What is the SMILES notation for 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride?
The canonical SMILES for 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride is COC1CC(NC(=O)C(N)c2ccc(C)cc2)C1(C)C.Cl.
What is the InChIKey of 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride?
The InChIKey is LAGNAZVAYHEHGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2.ClH/c1-10-5-7-11(8-6-10)14(17)15(19)18-12-9-13(20-4)16(12,2)3;/h5-8,12-14H,9,17H2,1-4H3,(H,18,19);1H.
What are the key properties of 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride?
2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride has a molecular weight of 312.84 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-methoxy-2,2-dimethylcyclobutyl)-2-(4-methylphenyl)acetamide;hydrochloride is sourced from PubChem (CID 120669141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).